![[5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one structure](/static/products/805/80562-39-6.png)
[5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
TL;DR: [5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one (CAS 80562-39-6) is a chemical compound with molecular formula C53H51Cl4N9O12S4 and molecular weight 1273.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate;11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: [5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one|5-(2,2-Dichloroacetamido)-2,4-bis(E)({4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}diazenyl)naphthalen-1-yl dichloroacetate--11,17,21-trihydroxypregn-4-ene-3,20-dione (1/1)
| Molecular Formula | C53H51Cl4N9O12S4 |
|---|---|
| Molecular Weight | 1273.13 g/mol |
| LogP | 11.4181 |
| Topological Polar Surface Area | 391.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 22 |
| Rotatable Bonds | 17 |
| Exact Mass | 1273.1294 |
| Heavy Atoms | 82 |
| Complexity | 2310.0 |
Chemical Identifiers
| CAS Number | 80562-39-6 |
|---|---|
| SMILES | CC12CCC(=O)C=C1CCC3C2C(CC4(C3CCC4(C(=O)CO)O)C)O.C1=CC2=C(C(=C1)NC(=O)C(Cl)Cl)C(=CC(=C2OC(=O)C(Cl)Cl)N=NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CS4)N=NC5=CC=C(C=C5)S(=O)(=O)NC6=NC=CS6 |
| InChIKey | LHMSZHVWEVERAI-UHFFFAOYSA-N |
Product Overview
[5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one (CAS 80562-39-6), with molecular formula C53H51Cl4N9O12S4 and molecular weight 1273.13 g/mol. IUPAC: [5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate;11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one.
Chemical Property Profile of [5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Property Insights of [5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
The XLogP value of 11.4181 indicates that [5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 391.0 Ų indicates high polarity, suggesting [5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one has 6 hydrogen bond donor(s) and 22 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one?
The CAS number of [5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one is 80562-39-6.
What is the molecular formula of [5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one?
The molecular formula of [5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one is C53H51Cl4N9O12S4.
What is the molecular weight of [5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one?
The molecular weight of [5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one is 1273.13 g/mol.
Where can I buy [5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one?
You can request a quote for [5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one?
Yes, KEHONG BIO provides custom synthesis services for [5-[(2,2-dichloroacetyl)amino]-2,4-bis[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-1-yl] 2,2-dichloroacetate; 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.