Methyl 4-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]benzoate
TL;DR: Methyl 4-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]benzoate (CAS 1004256-23-8) is a chemical compound with molecular formula C21H18N2O4 and molecular weight 362.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]benzoate
Also Known As: VU0495303-1, methyl 4-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]benzoate, F2744-0036, methyl 4-(1-benzyl-6-oxo-1,6-dihydropyridine-3-amido)benzoate, methyl 4-(1-benzyl-6-oxo-1,6-dihydropyridine-3-carboxamido)benzoate
| Molecular Formula | C21H18N2O4 |
|---|---|
| Molecular Weight | 362.13 g/mol |
| LogP | 2.9355 |
| Topological Polar Surface Area | 77.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 362.12665 |
| Heavy Atoms | 27 |
| Complexity | 1008.3565 |
Chemical Identifiers
| CAS Number | 1004256-23-8 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)NC(=O)C2=CN(C(=O)C=C2)CC3=CC=CC=C3 |
Product Overview
Methyl 4-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]benzoate (CAS 1004256-23-8), with molecular formula C21H18N2O4 and molecular weight 362.13 g/mol. IUPAC: methyl 4-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]benzoate.
Chemical Property Profile of Methyl 4-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]benzoate
Property Insights of Methyl 4-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]benzoate
The XLogP value of 2.9355 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]benzoate. The TPSA of 77.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]benzoate. Following Lipinski's Rule of Five, Methyl 4-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]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-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]benzoate?
The CAS number of Methyl 4-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]benzoate is 1004256-23-8.
What is the molecular formula of Methyl 4-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]benzoate?
The molecular formula of Methyl 4-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]benzoate is C21H18N2O4.
What is the molecular weight of Methyl 4-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]benzoate?
The molecular weight of Methyl 4-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]benzoate is 362.13 g/mol.
Where can I buy Methyl 4-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]benzoate?
You can request a quote for Methyl 4-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]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-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.