3-Amino-4-(p-aminoanilino)benzenesulfonic acid
TL;DR: 3-Amino-4-(p-aminoanilino)benzenesulfonic acid (CAS 97-34-7) is a chemical compound with molecular formula C12H13N3O3S and molecular weight 279.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-4-(4-aminoanilino)benzenesulfonic acid
Also Known As: 3-amino-4-(4-aminoanilino)benzenesulfonic acid, 3-Amino-4-(p-aminoanilino)benzenesulphonic acid, 3-Amino-4-(p-aminoanilino)benzenesulfonic acid, 3-amino-4-[(4-aminophenyl)amino]benzenesulfonic acid, Benzenesulfonic acid, 3-amino-4-[(4-aminophenyl)amino]-
| Molecular Formula | C12H13N3O3S |
|---|---|
| Molecular Weight | 279.07 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.06775 |
| Heavy Atoms | 19 |
| Complexity | 388.0 |
Chemical Identifiers
| CAS Number | 97-34-7 |
|---|---|
| SMILES | C1=CC(=CC=C1N)NC2=C(C=C(C=C2)S(=O)(=O)O)N |
| InChIKey | ACKJQSTXPUVROE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Amino-4-(p-aminoanilino)benzenesulfonic acid (CAS 97-34-7), with molecular formula C12H13N3O3S and molecular weight 279.07 g/mol. IUPAC: 3-amino-4-(4-aminoanilino)benzenesulfonic acid.
Chemical Property Profile of 3-Amino-4-(p-aminoanilino)benzenesulfonic acid
Property Insights of 3-Amino-4-(p-aminoanilino)benzenesulfonic acid
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-4-(p-aminoanilino)benzenesulfonic acid. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-4-(p-aminoanilino)benzenesulfonic acid. Following Lipinski's Rule of Five, 3-Amino-4-(p-aminoanilino)benzenesulfonic acid has 4 hydrogen bond donor(s) and 6 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 3-Amino-4-(p-aminoanilino)benzenesulfonic acid?
The CAS number of 3-Amino-4-(p-aminoanilino)benzenesulfonic acid is 97-34-7.
What is the molecular formula of 3-Amino-4-(p-aminoanilino)benzenesulfonic acid?
The molecular formula of 3-Amino-4-(p-aminoanilino)benzenesulfonic acid is C12H13N3O3S.
What is the molecular weight of 3-Amino-4-(p-aminoanilino)benzenesulfonic acid?
The molecular weight of 3-Amino-4-(p-aminoanilino)benzenesulfonic acid is 279.07 g/mol.
Where can I buy 3-Amino-4-(p-aminoanilino)benzenesulfonic acid?
You can request a quote for 3-Amino-4-(p-aminoanilino)benzenesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-4-(p-aminoanilino)benzenesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-4-(p-aminoanilino)benzenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.