ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate
TL;DR: ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate (CAS 4909-19-7) is a chemical compound with molecular formula C17H16ClNO4 and molecular weight 333.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate
Also Known As: ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate, Benzoic acid, 5-(((5-chloro-2-methylphenyl)amino)carbonyl)-2-hydroxy-, ethyl ester, Ethyl 5-(((5-chloro-2-methylphenyl)amino)carbonyl)-2-hydroxybenzoate, Benzoic acid,5-(((5-chloro-2-methylphenyl)amino)carbonyl)-2-hydroxy-,ethyl ester, BRN 2889956
| Molecular Formula | C17H16ClNO4 |
|---|---|
| Molecular Weight | 333.08 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.07678 |
| Heavy Atoms | 23 |
| Complexity | 431.0 |
Chemical Identifiers
| CAS Number | 4909-19-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(C=CC(=C1)C(=O)NC2=C(C=CC(=C2)Cl)C)O |
| InChIKey | QYSGSNCVNNCOII-UHFFFAOYSA-N |
Product Overview
ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate (CAS 4909-19-7), with molecular formula C17H16ClNO4 and molecular weight 333.08 g/mol. IUPAC: ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate.
Chemical Property Profile of ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate
Property Insights of ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate
The XLogP value of 4.2 indicates that ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate. Following Lipinski's Rule of Five, ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate has 2 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 ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate?
The CAS number of ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate is 4909-19-7.
What is the molecular formula of ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate?
The molecular formula of ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate is C17H16ClNO4.
What is the molecular weight of ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate?
The molecular weight of ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate is 333.08 g/mol.
Where can I buy ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate?
You can request a quote for ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 5-[(5-chloro-2-methylphenyl)carbamoyl]-2-hydroxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.