N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide
TL;DR: N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide (CAS 838870-77-2) is a chemical compound with molecular formula C14H18N2O5S and molecular weight 326.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide
Also Known As: BAS 12634625, N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide, 1-Methanesulfonyl-piperidine-3-carboxylic acid benzo[1,3]dioxol-5-ylamide, N-(1,3-benzodioxol-5-yl)-1-(methylsulfonyl)piperidine-3-carboxamide
| Molecular Formula | C14H18N2O5S |
|---|---|
| Molecular Weight | 326.09 g/mol |
| LogP | 1.0254 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 326.09363 |
| Heavy Atoms | 22 |
| Complexity | 688.47363 |
Chemical Identifiers
| CAS Number | 838870-77-2 |
|---|---|
| SMILES | CS(=O)(=O)N1CCCC(C1)C(=O)NC2=CC3=C(C=C2)OCO3 |
Product Overview
N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide (CAS 838870-77-2), with molecular formula C14H18N2O5S and molecular weight 326.09 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide
Property Insights of N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide
The XLogP value of 1.0254 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide has 1 hydrogen bond donor(s) and 5 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-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide?
The CAS number of N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide is 838870-77-2.
What is the molecular formula of N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide?
The molecular formula of N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide is C14H18N2O5S.
What is the molecular weight of N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide?
The molecular weight of N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide is 326.09 g/mol.
Where can I buy N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide?
You can request a quote for N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-yl)-1-methylsulfonylpiperidine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.