1-(6-Chloropyridine-3-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine
TL;DR: 1-(6-Chloropyridine-3-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine (CAS 748010-61-9) is a chemical compound with molecular formula C17H18ClN3O3S and molecular weight 379.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-chloro-3-pyridinyl)-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone
Also Known As: (6-chloropyridin-3-yl)-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone, 1-(6-chloropyridine-3-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine
| Molecular Formula | C17H18ClN3O3S |
|---|---|
| Molecular Weight | 379.08 g/mol |
| LogP | 2.19012 |
| Topological Polar Surface Area | 70.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 379.07574 |
| Heavy Atoms | 25 |
| Complexity | 859.016 |
Chemical Identifiers
| CAS Number | 748010-61-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN=C(C=C3)Cl |
Product Overview
1-(6-Chloropyridine-3-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine (CAS 748010-61-9), with molecular formula C17H18ClN3O3S and molecular weight 379.08 g/mol. IUPAC: (6-chloro-3-pyridinyl)-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone.
Chemical Property Profile of 1-(6-Chloropyridine-3-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine
Property Insights of 1-(6-Chloropyridine-3-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine
The XLogP value of 2.19012 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(6-Chloropyridine-3-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine. The TPSA of 70.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(6-Chloropyridine-3-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine. Following Lipinski's Rule of Five, 1-(6-Chloropyridine-3-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine has 0 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 1-(6-Chloropyridine-3-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine?
The CAS number of 1-(6-Chloropyridine-3-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine is 748010-61-9.
What is the molecular formula of 1-(6-Chloropyridine-3-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine?
The molecular formula of 1-(6-Chloropyridine-3-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine is C17H18ClN3O3S.
What is the molecular weight of 1-(6-Chloropyridine-3-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine?
The molecular weight of 1-(6-Chloropyridine-3-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine is 379.08 g/mol.
Where can I buy 1-(6-Chloropyridine-3-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine?
You can request a quote for 1-(6-Chloropyridine-3-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(6-Chloropyridine-3-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(6-Chloropyridine-3-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.