Acetic acid phenyl-P-tolylcarbamoyl-methyl ester
TL;DR: Acetic acid phenyl-P-tolylcarbamoyl-methyl ester (CAS 403613-14-9) is a chemical compound with molecular formula C17H17NO3 and molecular weight 283.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-methylanilino)-2-oxo-1-phenylethyl] acetate
Also Known As: ACETIC ACID PHENYL-P-TOLYLCARBAMOYL-METHYL ESTER, [2-(4-methylanilino)-2-oxo-1-phenylethyl] acetate
| Molecular Formula | C17H17NO3 |
|---|---|
| Molecular Weight | 283.12 g/mol |
| LogP | 3.23792 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 283.12085 |
| Heavy Atoms | 21 |
| Complexity | 620.2433 |
Chemical Identifiers
| CAS Number | 403613-14-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)C |
Product Overview
Acetic acid phenyl-P-tolylcarbamoyl-methyl ester (CAS 403613-14-9), with molecular formula C17H17NO3 and molecular weight 283.12 g/mol. IUPAC: [2-(4-methylanilino)-2-oxo-1-phenylethyl] acetate.
Chemical Property Profile of Acetic acid phenyl-P-tolylcarbamoyl-methyl ester
Property Insights of Acetic acid phenyl-P-tolylcarbamoyl-methyl ester
The XLogP value of 3.23792 indicates that Acetic acid phenyl-P-tolylcarbamoyl-methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Acetic acid phenyl-P-tolylcarbamoyl-methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid phenyl-P-tolylcarbamoyl-methyl ester 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 Acetic acid phenyl-P-tolylcarbamoyl-methyl ester?
The CAS number of Acetic acid phenyl-P-tolylcarbamoyl-methyl ester is 403613-14-9.
What is the molecular formula of Acetic acid phenyl-P-tolylcarbamoyl-methyl ester?
The molecular formula of Acetic acid phenyl-P-tolylcarbamoyl-methyl ester is C17H17NO3.
What is the molecular weight of Acetic acid phenyl-P-tolylcarbamoyl-methyl ester?
The molecular weight of Acetic acid phenyl-P-tolylcarbamoyl-methyl ester is 283.12 g/mol.
Where can I buy Acetic acid phenyl-P-tolylcarbamoyl-methyl ester?
You can request a quote for Acetic acid phenyl-P-tolylcarbamoyl-methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid phenyl-P-tolylcarbamoyl-methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid phenyl-P-tolylcarbamoyl-methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.