4-Amino-N-pyridin-3-ylmethyl-benzenesulfonamide
TL;DR: 4-Amino-N-pyridin-3-ylmethyl-benzenesulfonamide (CAS 88488-05-5) is a chemical compound with molecular formula C12H13N3O2S and molecular weight 263.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-N-(pyridin-3-ylmethyl)benzenesulfonamide
Also Known As: N-nicotinylsulfanilamide, 4-Amino-N-pyridin-3-ylmethyl-benzenesulfonamide, 4-amino-N-(pyridin-3-ylmethyl)benzenesulfonamide, 4-amino-N,N-dipropylbenzamide, BAS 01318522
| Molecular Formula | C12H13N3O2S |
|---|---|
| Molecular Weight | 263.07 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 93.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 263.07285 |
| Heavy Atoms | 18 |
| Complexity | 345.0 |
Chemical Identifiers
| CAS Number | 88488-05-5 |
|---|---|
| SMILES | C1=CC(=CN=C1)CNS(=O)(=O)C2=CC=C(C=C2)N |
| InChIKey | BOHJOLAPFDFLCC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Amino-N-pyridin-3-ylmethyl-benzenesulfonamide (CAS 88488-05-5), with molecular formula C12H13N3O2S and molecular weight 263.07 g/mol. IUPAC: 4-amino-N-(pyridin-3-ylmethyl)benzenesulfonamide.
Chemical Property Profile of 4-Amino-N-pyridin-3-ylmethyl-benzenesulfonamide
Property Insights of 4-Amino-N-pyridin-3-ylmethyl-benzenesulfonamide
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-N-pyridin-3-ylmethyl-benzenesulfonamide. The TPSA of 93.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-N-pyridin-3-ylmethyl-benzenesulfonamide. Following Lipinski's Rule of Five, 4-Amino-N-pyridin-3-ylmethyl-benzenesulfonamide has 2 hydrogen bond donor(s) and 5 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-Amino-N-pyridin-3-ylmethyl-benzenesulfonamide?
The CAS number of 4-Amino-N-pyridin-3-ylmethyl-benzenesulfonamide is 88488-05-5.
What is the molecular formula of 4-Amino-N-pyridin-3-ylmethyl-benzenesulfonamide?
The molecular formula of 4-Amino-N-pyridin-3-ylmethyl-benzenesulfonamide is C12H13N3O2S.
What is the molecular weight of 4-Amino-N-pyridin-3-ylmethyl-benzenesulfonamide?
The molecular weight of 4-Amino-N-pyridin-3-ylmethyl-benzenesulfonamide is 263.07 g/mol.
Where can I buy 4-Amino-N-pyridin-3-ylmethyl-benzenesulfonamide?
You can request a quote for 4-Amino-N-pyridin-3-ylmethyl-benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-N-pyridin-3-ylmethyl-benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-N-pyridin-3-ylmethyl-benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.