RefChem:446316
TL;DR: RefChem:446316 (CAS 67827-65-0) is a chemical compound with molecular formula C32H23Cl2N11Na4O13S4 and molecular weight 1058.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetrasodium;5-[[4-chloro-6-[3-[(4-chloro-6-propan-2-yl-1,3,5-triazin-2-yl)amino]-4-sulfonatoanilino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(4-methyl-2-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate
Also Known As: 2,7-Naphthalenedisulfonic acid, 5-((4-chloro-6-((3-((4-chloro-6-(1-methylethoxy)-1,3,5-triazin-2-yl)amino)-4-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-methyl-2-sulfophenyl)azo)-, tetrasodium salt, 2,7-Naphthalenedisulfonic acid, 5-((4-chloro-6-((3-((4-chloro-6-(1-methylethoxy)-1,3,5-triazin-2-yl)amino)-4-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-(2-(4-methyl-2-sulfophenyl)diazenyl)-, sodium salt (1:4), 2,7-Naphthalenedisulfonic acid, 5-[[4-chloro-6-[[3-[[4-chloro-6-(1-methylethoxy)-1,3,5-triazin-2-yl]amino]-4-sulfophenyl]amino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[2-(4-methyl-2-sulfophenyl)diazenyl]-, sodium salt (1:4), 5-[[4-Chloro-6-[[3-[[4-chloro-6-(1-methylethoxy)-1,3,5-triazin-2-yl]amino]-4-sulfophenyl]amino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[2-(4-methyl-2-sulfophenyl)diazenyl]-2,7-naphthalenedisulfonic acid sodium (1:4)
| Molecular Formula | C32H23Cl2N11Na4O13S4 |
|---|---|
| Molecular Weight | 1058.93 g/mol |
| LogP | -7.07 |
| Topological Polar Surface Area | 421.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 24 |
| Rotatable Bonds | 9 |
| Exact Mass | 1058.9327 |
| Heavy Atoms | 66 |
| Complexity | 1980.0 |
Chemical Identifiers
| CAS Number | 67827-65-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])NC4=NC(=NC(=N4)NC5=CC(=C(C=C5)S(=O)(=O)[O-])NC6=NC(=NC(=N6)C(C)C)Cl)Cl)O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+] |
| InChIKey | FHPCVNIAKQVHJE-UHFFFAOYSA-J |
Product Overview
RefChem:446316 (CAS 67827-65-0), with molecular formula C32H23Cl2N11Na4O13S4 and molecular weight 1058.93 g/mol. IUPAC: tetrasodium;5-[[4-chloro-6-[3-[(4-chloro-6-propan-2-yl-1,3,5-triazin-2-yl)amino]-4-sulfonatoanilino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(4-methyl-2-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate.
Chemical Property Profile of RefChem:446316
Property Insights of RefChem:446316
The XLogP value of -7.07 indicates that RefChem:446316 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 421.0 Ų indicates high polarity, suggesting RefChem:446316 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:446316 has 4 hydrogen bond donor(s) and 24 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:446316?
The CAS number of RefChem:446316 is 67827-65-0.
What is the molecular formula of RefChem:446316?
The molecular formula of RefChem:446316 is C32H23Cl2N11Na4O13S4.
What is the molecular weight of RefChem:446316?
The molecular weight of RefChem:446316 is 1058.93 g/mol.
Where can I buy RefChem:446316?
You can request a quote for RefChem:446316 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:446316?
Yes, KEHONG BIO provides custom synthesis services for RefChem:446316 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.