![Methyl 2-[1-(4-methylbenzenesulfonyl)piperidine-4-amido]benzoate structure](/static/products/4339/433956-61-7.webp)
Methyl 2-[1-(4-methylbenzenesulfonyl)piperidine-4-amido]benzoate
TL;DR: Methyl 2-[1-(4-methylbenzenesulfonyl)piperidine-4-amido]benzoate (CAS 433956-61-7) is a chemical compound with molecular formula C21H24N2O5S and molecular weight 416.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate
Also Known As: AH-487/41077590, methyl 2-(1-tosylpiperidine-4-carboxamido)benzoate, METHYL 2-[1-(4-METHYLBENZENESULFONYL)PIPERIDINE-4-AMIDO]BENZOATE, methyl 2-[[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate, methyl 2-[({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)amino]benzoate
| Molecular Formula | C21H24N2O5S |
|---|---|
| Molecular Weight | 416.14 g/mol |
| LogP | 2.82102 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 416.1406 |
| Heavy Atoms | 29 |
| Complexity | 993.98645 |
Chemical Identifiers
| CAS Number | 433956-61-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3C(=O)OC |
Product Overview
Methyl 2-[1-(4-methylbenzenesulfonyl)piperidine-4-amido]benzoate (CAS 433956-61-7), with molecular formula C21H24N2O5S and molecular weight 416.14 g/mol. IUPAC: methyl 2-[[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate.
Chemical Property Profile of Methyl 2-[1-(4-methylbenzenesulfonyl)piperidine-4-amido]benzoate
Property Insights of Methyl 2-[1-(4-methylbenzenesulfonyl)piperidine-4-amido]benzoate
The XLogP value of 2.82102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-[1-(4-methylbenzenesulfonyl)piperidine-4-amido]benzoate. The TPSA of 92.78 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[1-(4-methylbenzenesulfonyl)piperidine-4-amido]benzoate. Following Lipinski's Rule of Five, Methyl 2-[1-(4-methylbenzenesulfonyl)piperidine-4-amido]benzoate 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 Methyl 2-[1-(4-methylbenzenesulfonyl)piperidine-4-amido]benzoate?
The CAS number of Methyl 2-[1-(4-methylbenzenesulfonyl)piperidine-4-amido]benzoate is 433956-61-7.
What is the molecular formula of Methyl 2-[1-(4-methylbenzenesulfonyl)piperidine-4-amido]benzoate?
The molecular formula of Methyl 2-[1-(4-methylbenzenesulfonyl)piperidine-4-amido]benzoate is C21H24N2O5S.
What is the molecular weight of Methyl 2-[1-(4-methylbenzenesulfonyl)piperidine-4-amido]benzoate?
The molecular weight of Methyl 2-[1-(4-methylbenzenesulfonyl)piperidine-4-amido]benzoate is 416.14 g/mol.
Where can I buy Methyl 2-[1-(4-methylbenzenesulfonyl)piperidine-4-amido]benzoate?
You can request a quote for Methyl 2-[1-(4-methylbenzenesulfonyl)piperidine-4-amido]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[1-(4-methylbenzenesulfonyl)piperidine-4-amido]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[1-(4-methylbenzenesulfonyl)piperidine-4-amido]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.