Pregn-4-ene-3,20-dione, 21-(4-(diethylamino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)-
TL;DR: Pregn-4-ene-3,20-dione, 21-(4-(diethylamino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)- (CAS 74253-49-9) is a chemical compound with molecular formula C29H43NO7 and molecular weight 517.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 4-(diethylamino)-4-oxobutanoate
Also Known As: Pregn-4-ene-3,20-dione, 21-(4-(diethylamino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)-, 11,17-Dihydroxy-3,20-dioxopregn-4-en-21-yl 4-(diethylamino)-4-oxobutanoate, 11beta,17-Dihydroxy-3,20-dioxopregn-4-en-21-yl 4-(diethylamino)-4-oxobutanoate, 5-Thiazoleacetic acid, 2-(o-chlorobenzylamino)-4-(p-chlorophenyl)-, methyl ester, [2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 4-(diethylamino)-4-oxobutanoate
| Molecular Formula | C29H43NO7 |
|---|---|
| Molecular Weight | 517.30 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 517.30396 |
| Heavy Atoms | 37 |
| Complexity | 987.0 |
Chemical Identifiers
| CAS Number | 74253-49-9 |
|---|---|
| SMILES | CCN(CC)C(=O)CCC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)O)C)O |
| InChIKey | SEVVZFIPZIKVCU-MWRQVSSFSA-N |
Product Overview
Pregn-4-ene-3,20-dione, 21-(4-(diethylamino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)- (CAS 74253-49-9), with molecular formula C29H43NO7 and molecular weight 517.30 g/mol. IUPAC: [2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 4-(diethylamino)-4-oxobutanoate.
Chemical Property Profile of Pregn-4-ene-3,20-dione, 21-(4-(diethylamino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)-
Property Insights of Pregn-4-ene-3,20-dione, 21-(4-(diethylamino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pregn-4-ene-3,20-dione, 21-(4-(diethylamino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)-. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Pregn-4-ene-3,20-dione, 21-(4-(diethylamino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)-. Following Lipinski's Rule of Five, Pregn-4-ene-3,20-dione, 21-(4-(diethylamino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)- has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pregn-4-ene-3,20-dione, 21-(4-(diethylamino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)-?
The CAS number of Pregn-4-ene-3,20-dione, 21-(4-(diethylamino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)- is 74253-49-9.
What is the molecular formula of Pregn-4-ene-3,20-dione, 21-(4-(diethylamino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)-?
The molecular formula of Pregn-4-ene-3,20-dione, 21-(4-(diethylamino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)- is C29H43NO7.
What is the molecular weight of Pregn-4-ene-3,20-dione, 21-(4-(diethylamino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)-?
The molecular weight of Pregn-4-ene-3,20-dione, 21-(4-(diethylamino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)- is 517.30 g/mol.
Where can I buy Pregn-4-ene-3,20-dione, 21-(4-(diethylamino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)-?
You can request a quote for Pregn-4-ene-3,20-dione, 21-(4-(diethylamino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pregn-4-ene-3,20-dione, 21-(4-(diethylamino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)-?
Yes, KEHONG BIO provides custom synthesis services for Pregn-4-ene-3,20-dione, 21-(4-(diethylamino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.