CTK5D0154
TL;DR: CTK5D0154 (CAS 6949-22-0) is a chemical compound with molecular formula C40H35N9O7S and molecular weight 785.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[4-[4-[[2,4-diamino-3-[[4-(4-ethoxyanilino)-3-sulfophenyl]diazenyl]-5-methylphenyl]diazenyl]phenyl]phenyl]diazenyl]-2-hydroxybenzoic acid
Also Known As: Butanoic acid,2-amino-4-cyano-,(R), 5-((4'-((2,4-Diamino-3-((4-(4-ethoxyanilino)-3-sulfophenyl)diazenyl)-5-methylphenyl)diazenyl)[1,1'-biphenyl]-4-yl)diazenyl)-2-hydroxybenzoic acid, 3-[[4-[4-[[2,4-diamino-3-[[4-(4-ethoxyanilino)-3-sulfophenyl]diazenyl]-5-methylphenyl]diazenyl]phenyl]phenyl]hydrazinylidene]-6-oxocyclohexa-1,4-diene-1-carboxylic acid, 5-[(E)-[4-[4-[(E)-[2,4-diamino-3-[(E)-[4-(4-ethoxyanilino)-3-sulfo-phenyl]azo]-5-methyl-phenyl]azo]phenyl]phenyl]azo]-2-hydroxy-benzoic acid, Benzoic acid,5-[2-[4'-[2-[2,4-diamino-3-[2-[4-[(4-ethoxyphenyl)amino]-3-sulfophenyl]diazenyl]-5-methylphenyl]diazenyl][1,1'-biphenyl]-4-yl]diazenyl]-2-hydroxy-,sodium salt (1:2)
| Molecular Formula | C40H35N9O7S |
|---|---|
| Molecular Weight | 785.24 g/mol |
| LogP | 8.8 |
| Topological Polar Surface Area | 268.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 13 |
| Exact Mass | 785.23804 |
| Heavy Atoms | 57 |
| Complexity | 1480.0 |
Chemical Identifiers
| CAS Number | 6949-22-0 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC2=C(C=C(C=C2)N=NC3=C(C(=CC(=C3N)N=NC4=CC=C(C=C4)C5=CC=C(C=C5)N=NC6=CC(=C(C=C6)O)C(=O)O)C)N)S(=O)(=O)O |
| InChIKey | WIGUODXJYVJDCK-UHFFFAOYSA-N |
Product Overview
CTK5D0154 (CAS 6949-22-0), with molecular formula C40H35N9O7S and molecular weight 785.24 g/mol. IUPAC: 5-[[4-[4-[[2,4-diamino-3-[[4-(4-ethoxyanilino)-3-sulfophenyl]diazenyl]-5-methylphenyl]diazenyl]phenyl]phenyl]diazenyl]-2-hydroxybenzoic acid.
Chemical Property Profile of CTK5D0154
Property Insights of CTK5D0154
The XLogP value of 8.8 indicates that CTK5D0154 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 268.0 Ų indicates high polarity, suggesting CTK5D0154 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CTK5D0154 has 6 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CTK5D0154?
The CAS number of CTK5D0154 is 6949-22-0.
What is the molecular formula of CTK5D0154?
The molecular formula of CTK5D0154 is C40H35N9O7S.
What is the molecular weight of CTK5D0154?
The molecular weight of CTK5D0154 is 785.24 g/mol.
Where can I buy CTK5D0154?
You can request a quote for CTK5D0154 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK5D0154?
Yes, KEHONG BIO provides custom synthesis services for CTK5D0154 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.