Methyl 3-(phenylcarbamoyl)benzoate
TL;DR: Methyl 3-(phenylcarbamoyl)benzoate (CAS 139191-85-8) is a chemical compound with molecular formula C15H13NO3 and molecular weight 255.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(phenylcarbamoyl)benzoate
Also Known As: Methyl 3-(phenylcarbamoyl)benzoate, Methyl3-(phenylcarbamoyl)benzoate, methyl 3-(anilinocarbonyl)benzoate, methyl 3-(N-phenylcarbamoyl)benzoate
| Molecular Formula | C15H13NO3 |
|---|---|
| Molecular Weight | 255.09 g/mol |
| LogP | 2.7255 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 255.08954 |
| Heavy Atoms | 19 |
| Complexity | 593.3495 |
Chemical Identifiers
| CAS Number | 139191-85-8 |
|---|---|
| SMILES | COC(=O)C1=CC=CC(=C1)C(=O)NC2=CC=CC=C2 |
Product Overview
Methyl 3-(phenylcarbamoyl)benzoate (CAS 139191-85-8), with molecular formula C15H13NO3 and molecular weight 255.09 g/mol. IUPAC: methyl 3-(phenylcarbamoyl)benzoate.
Chemical Property Profile of Methyl 3-(phenylcarbamoyl)benzoate
Property Insights of Methyl 3-(phenylcarbamoyl)benzoate
The XLogP value of 2.7255 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-(phenylcarbamoyl)benzoate. With a topological polar surface area (TPSA) of 55.4 Ų, Methyl 3-(phenylcarbamoyl)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-(phenylcarbamoyl)benzoate 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 Methyl 3-(phenylcarbamoyl)benzoate?
The CAS number of Methyl 3-(phenylcarbamoyl)benzoate is 139191-85-8.
What is the molecular formula of Methyl 3-(phenylcarbamoyl)benzoate?
The molecular formula of Methyl 3-(phenylcarbamoyl)benzoate is C15H13NO3.
What is the molecular weight of Methyl 3-(phenylcarbamoyl)benzoate?
The molecular weight of Methyl 3-(phenylcarbamoyl)benzoate is 255.09 g/mol.
Where can I buy Methyl 3-(phenylcarbamoyl)benzoate?
You can request a quote for Methyl 3-(phenylcarbamoyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-(phenylcarbamoyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(phenylcarbamoyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.