2-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonyl chloride
TL;DR: 2-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonyl chloride (CAS 728864-75-3) is a chemical compound with molecular formula C13H16Cl2N2O3S and molecular weight 350.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-4-[(3-methylpiperidine-1-carbonyl)amino]benzenesulfonyl chloride
Also Known As: 2-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonyl chloride, 2-Chloro-4-[(3-methyl-piperidine-1-carbonyl)-amino]-benzenesulfonyl chloride, 2-chloro-4-[(3-methylpiperidine-1-carbonyl)amino]benzenesulfonyl Chloride, 2-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonylchloride
| Molecular Formula | C13H16Cl2N2O3S |
|---|---|
| Molecular Weight | 350.03 g/mol |
| LogP | 3.5313 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 350.02588 |
| Heavy Atoms | 21 |
| Complexity | 648.8165 |
Chemical Identifiers
| CAS Number | 728864-75-3 |
|---|---|
| SMILES | CC1CCCN(C1)C(=O)NC2=CC(=C(C=C2)S(=O)(=O)Cl)Cl |
Product Overview
2-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonyl chloride (CAS 728864-75-3), with molecular formula C13H16Cl2N2O3S and molecular weight 350.03 g/mol. IUPAC: 2-chloro-4-[(3-methylpiperidine-1-carbonyl)amino]benzenesulfonyl chloride.
Chemical Property Profile of 2-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonyl chloride
Property Insights of 2-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonyl chloride
The XLogP value of 3.5313 indicates that 2-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonyl chloride. Following Lipinski's Rule of Five, 2-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonyl chloride has 1 hydrogen bond donor(s) and 3 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-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonyl chloride?
The CAS number of 2-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonyl chloride is 728864-75-3.
What is the molecular formula of 2-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonyl chloride?
The molecular formula of 2-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonyl chloride is C13H16Cl2N2O3S.
What is the molecular weight of 2-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonyl chloride?
The molecular weight of 2-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonyl chloride is 350.03 g/mol.
Where can I buy 2-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonyl chloride?
You can request a quote for 2-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-4-(3-methylpiperidine-1-carboxamido)benzene-1-sulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.