Methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate
TL;DR: Methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate (CAS 102245-02-3) is a chemical compound with molecular formula C12H12ClNO3 and molecular weight 253.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate
Also Known As: methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate, 2-Propenoic acid, 2-(acetylamino)-3-(4-chlorophenyl)-, methyl ester, 2-Propenoic acid,2-(acetylamino)-3-(4-chlorophenyl)-, methyl ester, (2Z)-
| Molecular Formula | C12H12ClNO3 |
|---|---|
| Molecular Weight | 253.05 g/mol |
| LogP | 1.99 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.05057 |
| Heavy Atoms | 17 |
| Complexity | 451.3235 |
Chemical Identifiers
| CAS Number | 102245-02-3 |
|---|---|
| SMILES | CC(=O)NC(=CC1=CC=C(C=C1)Cl)C(=O)OC |
Product Overview
Methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate (CAS 102245-02-3), with molecular formula C12H12ClNO3 and molecular weight 253.05 g/mol. IUPAC: methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate.
Chemical Property Profile of Methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate
Property Insights of Methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate
The XLogP value of 1.99 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate. With a topological polar surface area (TPSA) of 55.4 Ų, Methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate 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 2-acetamido-3-(4-chlorophenyl)prop-2-enoate?
The CAS number of Methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate is 102245-02-3.
What is the molecular formula of Methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate?
The molecular formula of Methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate is C12H12ClNO3.
What is the molecular weight of Methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate?
The molecular weight of Methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate is 253.05 g/mol.
Where can I buy Methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate?
You can request a quote for Methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-acetamido-3-(4-chlorophenyl)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.