RefChem:416327
TL;DR: RefChem:416327 (CAS 64640-24-0) is a chemical compound with molecular formula C25H18ClN7O13S4 and molecular weight 786.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-chloro-6-[3-[(1-hydroxy-4-sulfonaphthalen-2-yl)diazenyl]-4-sulfoanilino]-1,3,5-triazin-2-yl]amino]benzene-1,4-disulfonic acid
Also Known As: 1,4-Benzenedisulfonic acid, 2-((4-chloro-6-((3-((1-hydroxy-4-sulfo-2-naphthalenyl)azo)-4-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-, 1,4-Benzenedisulfonic acid, 2-((4-chloro-6-((3-(2-(1-hydroxy-4-sulfo-2-naphthalenyl)diazenyl)-4-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-, 2-((4-Chloro-6-((3-((1-hydroxy-4-sulfo-2-naphthalenyl)azo)-4-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-1,4-benzenedisulfonic acid, 1,4-Benzenedisulfonic acid, 2-[[4-chloro-6-[[3-[(1-hydroxy-4-sulfo-2-naphthalenyl)azo]-4-sulfophenyl]amino]-1,3,5-triazin-2-yl]amino]-, 1,4-Benzenedisulfonic acid, 2-[[4-chloro-6-[[3-[2-(1-hydroxy-4-sulfo-2-naphthalenyl)diazenyl]-4-sulfophenyl]amino]-1,3,5-triazin-2-yl]amino]-
| Molecular Formula | C25H18ClN7O13S4 |
|---|---|
| Molecular Weight | 786.95 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 359.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 10 |
| Exact Mass | 786.95337 |
| Heavy Atoms | 50 |
| Complexity | 1670.0 |
Chemical Identifiers
| CAS Number | 64640-24-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC(=C2O)N=NC3=C(C=CC(=C3)NC4=NC(=NC(=N4)Cl)NC5=C(C=CC(=C5)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O |
| InChIKey | ISNBWRXLGUPJCR-UHFFFAOYSA-N |
Product Overview
RefChem:416327 (CAS 64640-24-0), with molecular formula C25H18ClN7O13S4 and molecular weight 786.95 g/mol. IUPAC: 2-[[4-chloro-6-[3-[(1-hydroxy-4-sulfonaphthalen-2-yl)diazenyl]-4-sulfoanilino]-1,3,5-triazin-2-yl]amino]benzene-1,4-disulfonic acid.
Chemical Property Profile of RefChem:416327
Property Insights of RefChem:416327
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:416327. The TPSA of 359.0 Ų indicates high polarity, suggesting RefChem:416327 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:416327 has 7 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:416327?
The CAS number of RefChem:416327 is 64640-24-0.
What is the molecular formula of RefChem:416327?
The molecular formula of RefChem:416327 is C25H18ClN7O13S4.
What is the molecular weight of RefChem:416327?
The molecular weight of RefChem:416327 is 786.95 g/mol.
Where can I buy RefChem:416327?
You can request a quote for RefChem:416327 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:416327?
Yes, KEHONG BIO provides custom synthesis services for RefChem:416327 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.