RefChem:811510
TL;DR: RefChem:811510 (CAS 27152-80-3) is a chemical compound with molecular formula C13H11N4NaO5S and molecular weight 358.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium [4-[(4-nitrophenyl)diazenyl]anilino]methanesulfonate
Also Known As: Methanesulfonic acid, ((4-((4-nitrophenyl)azo)phenyl)amino)-, sodium salt, Methanesulfonic acid, [[4-[(4-nitrophenyl)azo]phenyl]amino]-, monosodium salt, Sodium (4-((4-nitrophenyl)azo)anilino)methanesulphonate, Methanesulfonic acid, 1-((4-(2-(4-nitrophenyl)diazenyl)phenyl)amino)-, sodium salt (1:1), sodium [4-[(4-nitrophenyl)diazenyl]anilino]methanesulfonate
| Molecular Formula | C13H11N4NaO5S |
|---|---|
| Molecular Weight | 358.03 g/mol |
| LogP | -0.07 |
| Topological Polar Surface Area | 148.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.0348 |
| Heavy Atoms | 24 |
| Complexity | 498.0 |
Chemical Identifiers
| CAS Number | 27152-80-3 |
|---|---|
| SMILES | C1=CC(=CC=C1NCS(=O)(=O)[O-])N=NC2=CC=C(C=C2)[N+](=O)[O-].[Na+] |
| InChIKey | YYPBPJHNSVTSLD-UHFFFAOYSA-M |
Product Overview
RefChem:811510 (CAS 27152-80-3), with molecular formula C13H11N4NaO5S and molecular weight 358.03 g/mol. IUPAC: sodium [4-[(4-nitrophenyl)diazenyl]anilino]methanesulfonate.
Chemical Property Profile of RefChem:811510
Property Insights of RefChem:811510
The XLogP value of -0.07 indicates that RefChem:811510 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 148.0 Ų indicates high polarity, suggesting RefChem:811510 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:811510 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:811510?
The CAS number of RefChem:811510 is 27152-80-3.
What is the molecular formula of RefChem:811510?
The molecular formula of RefChem:811510 is C13H11N4NaO5S.
What is the molecular weight of RefChem:811510?
The molecular weight of RefChem:811510 is 358.03 g/mol.
Where can I buy RefChem:811510?
You can request a quote for RefChem:811510 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:811510?
Yes, KEHONG BIO provides custom synthesis services for RefChem:811510 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.