1-(Toluene-4-sulfonyl)-piperidine-4-carboxylic acid phenethyl-amide
TL;DR: 1-(Toluene-4-sulfonyl)-piperidine-4-carboxylic acid phenethyl-amide (CAS 433699-34-4) is a chemical compound with molecular formula C21H26N2O3S and molecular weight 386.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)sulfonyl-N-(2-phenylethyl)piperidine-4-carboxamide
Also Known As: BAS 05018812, 1-(Toluene-4-sulfonyl)-piperidine-4-carboxylic acid phenethyl-amide, 1-(4-METHYLBENZENESULFONYL)-N-(2-PHENYLETHYL)PIPERIDINE-4-CARBOXAMIDE, 1-(4-methylphenyl)sulfonyl-N-phenethylpiperidine-4-carboxamide, {1-[(4-methylphenyl)sulfonyl](4-piperidyl)}-N-(2-phenylethyl)carboxamide
| Molecular Formula | C21H26N2O3S |
|---|---|
| Molecular Weight | 386.17 g/mol |
| LogP | 2.75462 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 386.1664 |
| Heavy Atoms | 27 |
| Complexity | 856.0596 |
Chemical Identifiers
| CAS Number | 433699-34-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCC3=CC=CC=C3 |
Product Overview
1-(Toluene-4-sulfonyl)-piperidine-4-carboxylic acid phenethyl-amide (CAS 433699-34-4), with molecular formula C21H26N2O3S and molecular weight 386.17 g/mol. IUPAC: 1-(4-methylphenyl)sulfonyl-N-(2-phenylethyl)piperidine-4-carboxamide.
Chemical Property Profile of 1-(Toluene-4-sulfonyl)-piperidine-4-carboxylic acid phenethyl-amide
Property Insights of 1-(Toluene-4-sulfonyl)-piperidine-4-carboxylic acid phenethyl-amide
The XLogP value of 2.75462 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Toluene-4-sulfonyl)-piperidine-4-carboxylic acid phenethyl-amide. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Toluene-4-sulfonyl)-piperidine-4-carboxylic acid phenethyl-amide. Following Lipinski's Rule of Five, 1-(Toluene-4-sulfonyl)-piperidine-4-carboxylic acid phenethyl-amide 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 1-(Toluene-4-sulfonyl)-piperidine-4-carboxylic acid phenethyl-amide?
The CAS number of 1-(Toluene-4-sulfonyl)-piperidine-4-carboxylic acid phenethyl-amide is 433699-34-4.
What is the molecular formula of 1-(Toluene-4-sulfonyl)-piperidine-4-carboxylic acid phenethyl-amide?
The molecular formula of 1-(Toluene-4-sulfonyl)-piperidine-4-carboxylic acid phenethyl-amide is C21H26N2O3S.
What is the molecular weight of 1-(Toluene-4-sulfonyl)-piperidine-4-carboxylic acid phenethyl-amide?
The molecular weight of 1-(Toluene-4-sulfonyl)-piperidine-4-carboxylic acid phenethyl-amide is 386.17 g/mol.
Where can I buy 1-(Toluene-4-sulfonyl)-piperidine-4-carboxylic acid phenethyl-amide?
You can request a quote for 1-(Toluene-4-sulfonyl)-piperidine-4-carboxylic acid phenethyl-amide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Toluene-4-sulfonyl)-piperidine-4-carboxylic acid phenethyl-amide?
Yes, KEHONG BIO provides custom synthesis services for 1-(Toluene-4-sulfonyl)-piperidine-4-carboxylic acid phenethyl-amide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.