N-(3-chloropropyl)-4-methylbenzenesulfonamide
TL;DR: N-(3-chloropropyl)-4-methylbenzenesulfonamide (CAS 13379-99-2) is a chemical compound with molecular formula C10H14ClNO2S and molecular weight 247.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloropropyl)-4-methylbenzenesulfonamide
Also Known As: Urapidil Impurity 88, N-(3-chloropropyl)-4-methylbenzenesulfonamide, N-(3-Chloropropyl)-p-toluenesulfonamide, N-(3-chloropropyl)-4-methylbenzene-1-sulfonamide, J1.406.599G
| Molecular Formula | C10H14ClNO2S |
|---|---|
| Molecular Weight | 247.04 g/mol |
| LogP | 1.90222 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 247.04338 |
| Heavy Atoms | 15 |
| Complexity | 399.9355 |
Chemical Identifiers
| CAS Number | 13379-99-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NCCCCl |
Product Overview
N-(3-chloropropyl)-4-methylbenzenesulfonamide (CAS 13379-99-2), with molecular formula C10H14ClNO2S and molecular weight 247.04 g/mol. IUPAC: N-(3-chloropropyl)-4-methylbenzenesulfonamide.
Chemical Property Profile of N-(3-chloropropyl)-4-methylbenzenesulfonamide
Property Insights of N-(3-chloropropyl)-4-methylbenzenesulfonamide
The XLogP value of 1.90222 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-chloropropyl)-4-methylbenzenesulfonamide. With a topological polar surface area (TPSA) of 46.17 Ų, N-(3-chloropropyl)-4-methylbenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-chloropropyl)-4-methylbenzenesulfonamide 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 N-(3-chloropropyl)-4-methylbenzenesulfonamide?
The CAS number of N-(3-chloropropyl)-4-methylbenzenesulfonamide is 13379-99-2.
What is the molecular formula of N-(3-chloropropyl)-4-methylbenzenesulfonamide?
The molecular formula of N-(3-chloropropyl)-4-methylbenzenesulfonamide is C10H14ClNO2S.
What is the molecular weight of N-(3-chloropropyl)-4-methylbenzenesulfonamide?
The molecular weight of N-(3-chloropropyl)-4-methylbenzenesulfonamide is 247.04 g/mol.
Where can I buy N-(3-chloropropyl)-4-methylbenzenesulfonamide?
You can request a quote for N-(3-chloropropyl)-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-chloropropyl)-4-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chloropropyl)-4-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.