Methyl 4-anilinocarbonylbenzoate
TL;DR: Methyl 4-anilinocarbonylbenzoate (CAS 3814-10-6) 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 4-(phenylcarbamoyl)benzoate
Also Known As: methyl 4-(phenylcarbamoyl)benzoate, Methyl 4-(N-phenylcaramoyl)benzoate, Methyl 4-anilinocarbonylbenzoate, 4-Methoxycarbonylbenzanilide, Methyl 4-(N-phenylcaramoyl)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 | 576.0995 |
Chemical Identifiers
| CAS Number | 3814-10-6 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2 |
Product Overview
Methyl 4-anilinocarbonylbenzoate (CAS 3814-10-6), with molecular formula C15H13NO3 and molecular weight 255.09 g/mol. IUPAC: methyl 4-(phenylcarbamoyl)benzoate.
Chemical Property Profile of Methyl 4-anilinocarbonylbenzoate
Property Insights of Methyl 4-anilinocarbonylbenzoate
The XLogP value of 2.7255 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-anilinocarbonylbenzoate. With a topological polar surface area (TPSA) of 55.4 Ų, Methyl 4-anilinocarbonylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-anilinocarbonylbenzoate 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 4-anilinocarbonylbenzoate?
The CAS number of Methyl 4-anilinocarbonylbenzoate is 3814-10-6.
What is the molecular formula of Methyl 4-anilinocarbonylbenzoate?
The molecular formula of Methyl 4-anilinocarbonylbenzoate is C15H13NO3.
What is the molecular weight of Methyl 4-anilinocarbonylbenzoate?
The molecular weight of Methyl 4-anilinocarbonylbenzoate is 255.09 g/mol.
Where can I buy Methyl 4-anilinocarbonylbenzoate?
You can request a quote for Methyl 4-anilinocarbonylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-anilinocarbonylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-anilinocarbonylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.