Methyl 4-((4-Carbamoylpiperidin-1-yl)methyl)benzoate
TL;DR: Methyl 4-((4-Carbamoylpiperidin-1-yl)methyl)benzoate (CAS 733783-20-5) is a chemical compound with molecular formula C15H20N2O3 and molecular weight 276.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(4-carbamoylpiperidin-1-yl)methyl]benzoate
Also Known As: Revefenacin Impurity 63, REVEFENACIN IMPURITY 38, Methyl 4-((4-Carbamoylpiperidin-1-yl)methyl)benzoate, Methyl 4-[(4-carbamoyl-1-piperidyl)methyl]benzoate, Methyl Ester 4- [[4- (Aminocarbonyl) - 1- piperidinyl] methyl] - benzoic Acid
| Molecular Formula | C15H20N2O3 |
|---|---|
| Molecular Weight | 276.15 g/mol |
| LogP | 1.1705 |
| Topological Polar Surface Area | 72.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.1474 |
| Heavy Atoms | 20 |
| Complexity | 476.3969 |
Chemical Identifiers
| CAS Number | 733783-20-5 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)CN2CCC(CC2)C(=O)N |
Product Overview
Methyl 4-((4-Carbamoylpiperidin-1-yl)methyl)benzoate (CAS 733783-20-5), with molecular formula C15H20N2O3 and molecular weight 276.15 g/mol. IUPAC: methyl 4-[(4-carbamoylpiperidin-1-yl)methyl]benzoate.
Chemical Property Profile of Methyl 4-((4-Carbamoylpiperidin-1-yl)methyl)benzoate
Property Insights of Methyl 4-((4-Carbamoylpiperidin-1-yl)methyl)benzoate
The XLogP value of 1.1705 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-((4-Carbamoylpiperidin-1-yl)methyl)benzoate. The TPSA of 72.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-((4-Carbamoylpiperidin-1-yl)methyl)benzoate. Following Lipinski's Rule of Five, Methyl 4-((4-Carbamoylpiperidin-1-yl)methyl)benzoate 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 Methyl 4-((4-Carbamoylpiperidin-1-yl)methyl)benzoate?
The CAS number of Methyl 4-((4-Carbamoylpiperidin-1-yl)methyl)benzoate is 733783-20-5.
What is the molecular formula of Methyl 4-((4-Carbamoylpiperidin-1-yl)methyl)benzoate?
The molecular formula of Methyl 4-((4-Carbamoylpiperidin-1-yl)methyl)benzoate is C15H20N2O3.
What is the molecular weight of Methyl 4-((4-Carbamoylpiperidin-1-yl)methyl)benzoate?
The molecular weight of Methyl 4-((4-Carbamoylpiperidin-1-yl)methyl)benzoate is 276.15 g/mol.
Where can I buy Methyl 4-((4-Carbamoylpiperidin-1-yl)methyl)benzoate?
You can request a quote for Methyl 4-((4-Carbamoylpiperidin-1-yl)methyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-((4-Carbamoylpiperidin-1-yl)methyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-((4-Carbamoylpiperidin-1-yl)methyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.