N-allyl-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide
TL;DR: N-allyl-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide (CAS 433689-41-9) is a chemical compound with molecular formula C16H22N2O3S and molecular weight 322.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)sulfonyl-N-prop-2-enylpiperidine-4-carboxamide
Also Known As: N-allyl-1-tosylpiperidine-4-carboxamide, BAS 05018832, N-allyl-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide, 1-(4-methylbenzenesulfonyl)-N-(prop-2-en-1-yl)piperidine-4-carboxamide, 4R-1132
| Molecular Formula | C16H22N2O3S |
|---|---|
| Molecular Weight | 322.14 g/mol |
| LogP | 1.69792 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 322.1351 |
| Heavy Atoms | 22 |
| Complexity | 629.8597 |
Chemical Identifiers
| CAS Number | 433689-41-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC=C |
Product Overview
N-allyl-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide (CAS 433689-41-9), with molecular formula C16H22N2O3S and molecular weight 322.14 g/mol. IUPAC: 1-(4-methylphenyl)sulfonyl-N-prop-2-enylpiperidine-4-carboxamide.
Chemical Property Profile of N-allyl-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide
Property Insights of N-allyl-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide
The XLogP value of 1.69792 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-allyl-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for N-allyl-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide. Following Lipinski's Rule of Five, N-allyl-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide 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 N-allyl-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide?
The CAS number of N-allyl-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide is 433689-41-9.
What is the molecular formula of N-allyl-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide?
The molecular formula of N-allyl-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide is C16H22N2O3S.
What is the molecular weight of N-allyl-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide?
The molecular weight of N-allyl-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide is 322.14 g/mol.
Where can I buy N-allyl-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide?
You can request a quote for N-allyl-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-allyl-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-allyl-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.