3-methyl-N-phenylbenzene-1-sulfonamide
TL;DR: 3-methyl-N-phenylbenzene-1-sulfonamide (CAS 116436-08-9) is a chemical compound with molecular formula C13H13NO2S and molecular weight 247.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-N-phenylbenzenesulfonamide
Also Known As: 3-methyl-N-phenylbenzene-1-sulfonamide, 3-methyl-N-phenylbenzenesulfonamide
| Molecular Formula | C13H13NO2S |
|---|---|
| Molecular Weight | 247.07 g/mol |
| LogP | 2.79582 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.0667 |
| Heavy Atoms | 17 |
| Complexity | 606.3264 |
Chemical Identifiers
| CAS Number | 116436-08-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)S(=O)(=O)NC2=CC=CC=C2 |
Product Overview
3-methyl-N-phenylbenzene-1-sulfonamide (CAS 116436-08-9), with molecular formula C13H13NO2S and molecular weight 247.07 g/mol. IUPAC: 3-methyl-N-phenylbenzenesulfonamide.
Chemical Property Profile of 3-methyl-N-phenylbenzene-1-sulfonamide
Property Insights of 3-methyl-N-phenylbenzene-1-sulfonamide
The XLogP value of 2.79582 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methyl-N-phenylbenzene-1-sulfonamide. With a topological polar surface area (TPSA) of 46.17 Ų, 3-methyl-N-phenylbenzene-1-sulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-methyl-N-phenylbenzene-1-sulfonamide has 1 hydrogen bond donor(s) and 2 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-methyl-N-phenylbenzene-1-sulfonamide?
The CAS number of 3-methyl-N-phenylbenzene-1-sulfonamide is 116436-08-9.
What is the molecular formula of 3-methyl-N-phenylbenzene-1-sulfonamide?
The molecular formula of 3-methyl-N-phenylbenzene-1-sulfonamide is C13H13NO2S.
What is the molecular weight of 3-methyl-N-phenylbenzene-1-sulfonamide?
The molecular weight of 3-methyl-N-phenylbenzene-1-sulfonamide is 247.07 g/mol.
Where can I buy 3-methyl-N-phenylbenzene-1-sulfonamide?
You can request a quote for 3-methyl-N-phenylbenzene-1-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-N-phenylbenzene-1-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-N-phenylbenzene-1-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.