![4-[(4-Amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid structure](/static/products/1122/112299-11-3.webp)
4-[(4-Amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid
TL;DR: 4-[(4-Amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid (CAS 112299-11-3) is a chemical compound with molecular formula C9H9N5O3S and molecular weight 267.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid
Also Known As: N(4-Amino-S-Triazin-2-Yl)-Sulfanilic Acid, 4-[(4-amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid, BENZENESULFONIC ACID, 4-[(4-AMINO-1,3,5-TRIAZIN-2-YL)AMINO]-
| Molecular Formula | C9H9N5O3S |
|---|---|
| Molecular Weight | 267.04 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.0426 |
| Heavy Atoms | 18 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 112299-11-3 |
|---|---|
| SMILES | C1=CC(=CC=C1NC2=NC=NC(=N2)N)S(=O)(=O)O |
| InChIKey | YBRAXUZRHJNYFM-UHFFFAOYSA-N |
Product Overview
4-[(4-Amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid (CAS 112299-11-3), with molecular formula C9H9N5O3S and molecular weight 267.04 g/mol. IUPAC: 4-[(4-amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid.
Chemical Property Profile of 4-[(4-Amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid
Property Insights of 4-[(4-Amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(4-Amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(4-Amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid. Following Lipinski's Rule of Five, 4-[(4-Amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid has 3 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 4-[(4-Amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid?
The CAS number of 4-[(4-Amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid is 112299-11-3.
What is the molecular formula of 4-[(4-Amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid?
The molecular formula of 4-[(4-Amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid is C9H9N5O3S.
What is the molecular weight of 4-[(4-Amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid?
The molecular weight of 4-[(4-Amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid is 267.04 g/mol.
Where can I buy 4-[(4-Amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid?
You can request a quote for 4-[(4-Amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(4-Amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(4-Amino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.