1-(methylsulfonyl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide
TL;DR: 1-(methylsulfonyl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide (CAS 838875-22-2) is a chemical compound with molecular formula C14H20N2O3S2 and molecular weight 328.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methylsulfanylphenyl)-1-methylsulfonylpiperidine-3-carboxamide
Also Known As: BAS 12634657, VU0637073-1, AB00372589-07, F5140-0431, 1-(methylsulfonyl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide
| Molecular Formula | C14H20N2O3S2 |
|---|---|
| Molecular Weight | 328.09 g/mol |
| LogP | 2.0186 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.09152 |
| Heavy Atoms | 21 |
| Complexity | 616.4001 |
Chemical Identifiers
| CAS Number | 838875-22-2 |
|---|---|
| SMILES | CSC1=CC=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)C |
Product Overview
1-(methylsulfonyl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide (CAS 838875-22-2), with molecular formula C14H20N2O3S2 and molecular weight 328.09 g/mol. IUPAC: N-(2-methylsulfanylphenyl)-1-methylsulfonylpiperidine-3-carboxamide.
Chemical Property Profile of 1-(methylsulfonyl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide
Property Insights of 1-(methylsulfonyl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide
The XLogP value of 2.0186 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(methylsulfonyl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(methylsulfonyl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide. Following Lipinski's Rule of Five, 1-(methylsulfonyl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide 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 1-(methylsulfonyl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide?
The CAS number of 1-(methylsulfonyl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide is 838875-22-2.
What is the molecular formula of 1-(methylsulfonyl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide?
The molecular formula of 1-(methylsulfonyl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide is C14H20N2O3S2.
What is the molecular weight of 1-(methylsulfonyl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide?
The molecular weight of 1-(methylsulfonyl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide is 328.09 g/mol.
Where can I buy 1-(methylsulfonyl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide?
You can request a quote for 1-(methylsulfonyl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(methylsulfonyl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-(methylsulfonyl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.