2,4,5-Trimethylbenzenesulfonamide
TL;DR: 2,4,5-Trimethylbenzenesulfonamide (CAS 90643-45-1) is a chemical compound with molecular formula C9H13NO2S and molecular weight 199.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,5-trimethylbenzenesulfonamide
Also Known As: 2,4,5-trimethylbenzenesulfonamide, 2,4,5-trimethylbenzene-1-sulfonamide, Benzenesulfonamide, 2,4,5-trimethyl- (7CI,9CI), BENZENESULFONAMIDE, 2,4,5-TRIMETHYL-
| Molecular Formula | C9H13NO2S |
|---|---|
| Molecular Weight | 199.07 g/mol |
| LogP | 1.25926 |
| Topological Polar Surface Area | 60.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 199.0667 |
| Heavy Atoms | 13 |
| Complexity | 435.17307 |
Chemical Identifiers
| CAS Number | 90643-45-1 |
|---|---|
| SMILES | CC1=CC(=C(C=C1C)S(=O)(=O)N)C |
Product Overview
2,4,5-Trimethylbenzenesulfonamide (CAS 90643-45-1), with molecular formula C9H13NO2S and molecular weight 199.07 g/mol. IUPAC: 2,4,5-trimethylbenzenesulfonamide.
Chemical Property Profile of 2,4,5-Trimethylbenzenesulfonamide
Property Insights of 2,4,5-Trimethylbenzenesulfonamide
The XLogP value of 1.25926 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4,5-Trimethylbenzenesulfonamide. The TPSA of 60.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4,5-Trimethylbenzenesulfonamide. Following Lipinski's Rule of Five, 2,4,5-Trimethylbenzenesulfonamide 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 2,4,5-Trimethylbenzenesulfonamide?
The CAS number of 2,4,5-Trimethylbenzenesulfonamide is 90643-45-1.
What is the molecular formula of 2,4,5-Trimethylbenzenesulfonamide?
The molecular formula of 2,4,5-Trimethylbenzenesulfonamide is C9H13NO2S.
What is the molecular weight of 2,4,5-Trimethylbenzenesulfonamide?
The molecular weight of 2,4,5-Trimethylbenzenesulfonamide is 199.07 g/mol.
Where can I buy 2,4,5-Trimethylbenzenesulfonamide?
You can request a quote for 2,4,5-Trimethylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,5-Trimethylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 2,4,5-Trimethylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.