N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide
TL;DR: N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide (CAS 4294-36-4) is a chemical compound with molecular formula C10H12ClNO3S and molecular weight 261.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide
Also Known As: Tosylglycine chloromethyl ketone, Tos-Gly-chloromethyl ketone, N-Tosyl-glycine chloromethyl ketone, Tosyl-L-glycine chloromethyl ketone, N-(3-Chloro-2-oxopropyl)-4-methylbenzenesulfonamide
| Molecular Formula | C10H12ClNO3S |
|---|---|
| Molecular Weight | 261.02 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 71.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 261.02264 |
| Heavy Atoms | 16 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 4294-36-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)CCl |
| InChIKey | FYWPFRISLQPWSR-UHFFFAOYSA-N |
Product Overview
N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide (CAS 4294-36-4), with molecular formula C10H12ClNO3S and molecular weight 261.02 g/mol. IUPAC: N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide.
Chemical Property Profile of N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide
Property Insights of N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide. The TPSA of 71.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide. Following Lipinski's Rule of Five, N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide has 1 hydrogen bond donor(s) and 4 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 N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide?
The CAS number of N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide is 4294-36-4.
What is the molecular formula of N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide?
The molecular formula of N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide is C10H12ClNO3S.
What is the molecular weight of N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide?
The molecular weight of N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide is 261.02 g/mol.
Where can I buy N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide?
You can request a quote for N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chloro-2-oxopropyl)-4-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.