CTK5F0490
TL;DR: CTK5F0490 (CAS 83221-59-4) is a chemical compound with molecular formula C37H25KN7NaO9S and molecular weight 805.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
potassium;sodium;5-[[4-[[4-[[6-[(4-aminobenzoyl)amino]-1-hydroxy-3-sulfonatonaphthalen-2-yl]diazenyl]phenyl]carbamoyl]phenyl]diazenyl]-2-hydroxybenzoate
Also Known As: EINECS 280-237-6, Potassium sodium 5-((4-(((4-((6-((4-aminobenzoyl)amino)-1-hydroxy-3-sulphonato-2-naphthyl)azo)phenyl)amino)carbonyl)phenyl)azo)salicylate, Benzoic acid,5-[2-[4-[[[4-[2-[6-[(4-aminobenzoyl)amino]-1-hydroxy-3-sulfo-2-naphthalenyl]diazenyl]phenyl]amino]carbonyl]phenyl]diazenyl]-2-hydroxy-,potassium sodium salt (1:?:?), potassiumsodium5-[[4-[[[4-[[6-[ amino]-1-hydroxy-3-sulphonato-2-naphthyl]azo]phenyl]amino]carbonyl]phenyl]azo]salicylate
| Molecular Formula | C37H25KN7NaO9S |
|---|---|
| Molecular Weight | 805.10 g/mol |
| LogP | 0.4442 |
| Topological Polar Surface Area | 271.45 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 10 |
| Exact Mass | 805.0969 |
| Heavy Atoms | 56 |
| Complexity | 2626.29 |
Chemical Identifiers
| CAS Number | 83221-59-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)NC2=CC3=CC(=C(C(=C3C=C2)O)N=NC4=CC=C(C=C4)NC(=O)C5=CC=C(C=C5)N=NC6=CC(=C(C=C6)O)C(=O)[O-])S(=O)(=O)[O-])N.[Na+].[K+] |
Product Overview
CTK5F0490 (CAS 83221-59-4), with molecular formula C37H25KN7NaO9S and molecular weight 805.10 g/mol. IUPAC: potassium;sodium;5-[[4-[[4-[[6-[(4-aminobenzoyl)amino]-1-hydroxy-3-sulfonatonaphthalen-2-yl]diazenyl]phenyl]carbamoyl]phenyl]diazenyl]-2-hydroxybenzoate.
Chemical Property Profile of CTK5F0490
Property Insights of CTK5F0490
The XLogP value of 0.4442 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK5F0490. The TPSA of 271.45 Ų indicates high polarity, suggesting CTK5F0490 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CTK5F0490 has 5 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CTK5F0490?
The CAS number of CTK5F0490 is 83221-59-4.
What is the molecular formula of CTK5F0490?
The molecular formula of CTK5F0490 is C37H25KN7NaO9S.
What is the molecular weight of CTK5F0490?
The molecular weight of CTK5F0490 is 805.10 g/mol.
Where can I buy CTK5F0490?
You can request a quote for CTK5F0490 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK5F0490?
Yes, KEHONG BIO provides custom synthesis services for CTK5F0490 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.