CTK5C1613
TL;DR: CTK5C1613 (CAS 6470-31-1) is a chemical compound with molecular formula C32H20Cl2N6Na2O6S2 and molecular weight 764.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;4-amino-3-[[4-[4-[(1-amino-4-sulfonatonaphthalen-2-yl)diazenyl]-3-chlorophenyl]-2-chlorophenyl]diazenyl]naphthalene-1-sulfonate
Also Known As: C.I. Direct Red 61 disodium salt, C.I. DIRECT RED 61, DISODIUM SALT, Disodium 3,3'-((3,3'-dichloro(1,1'-biphenyl)-4,4'-diyl)bis(azo))bis(4-aminonaphthalene-1-sulphonate), disodium;4-amino-3-[[4-[4-[(1-amino-4-sulfonatonaphthalen-2-yl)diazenyl]-3-chlorophenyl]-2-chlorophenyl]diazenyl]naphthalene-1-sulfonate, (1,1'-Biphenyl)-2,2'-disulfonic acid,4-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-4'-((2-hydroxy-1-naphthalenyl)azo)-,disodium salt
| Molecular Formula | C32H20Cl2N6Na2O6S2 |
|---|---|
| Molecular Weight | 764.01 g/mol |
| LogP | 2.78 |
| Topological Polar Surface Area | 233.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 5 |
| Exact Mass | 764.0058 |
| Heavy Atoms | 50 |
| Complexity | 1270.0 |
Chemical Identifiers
| CAS Number | 6470-31-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC(=C2N)N=NC3=C(C=C(C=C3)C4=CC(=C(C=C4)N=NC5=C(C6=CC=CC=C6C(=C5)S(=O)(=O)[O-])N)Cl)Cl)S(=O)(=O)[O-].[Na+].[Na+] |
| InChIKey | NRXDNEXGDVFWIR-UHFFFAOYSA-L |
Product Overview
CTK5C1613 (CAS 6470-31-1), with molecular formula C32H20Cl2N6Na2O6S2 and molecular weight 764.01 g/mol. IUPAC: disodium;4-amino-3-[[4-[4-[(1-amino-4-sulfonatonaphthalen-2-yl)diazenyl]-3-chlorophenyl]-2-chlorophenyl]diazenyl]naphthalene-1-sulfonate.
Chemical Property Profile of CTK5C1613
Property Insights of CTK5C1613
The XLogP value of 2.78 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK5C1613. The TPSA of 233.0 Ų indicates high polarity, suggesting CTK5C1613 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CTK5C1613 has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CTK5C1613?
The CAS number of CTK5C1613 is 6470-31-1.
What is the molecular formula of CTK5C1613?
The molecular formula of CTK5C1613 is C32H20Cl2N6Na2O6S2.
What is the molecular weight of CTK5C1613?
The molecular weight of CTK5C1613 is 764.01 g/mol.
Where can I buy CTK5C1613?
You can request a quote for CTK5C1613 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK5C1613?
Yes, KEHONG BIO provides custom synthesis services for CTK5C1613 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.