Ethyl 3-(p-acetamidoanilino)crotonate
TL;DR: Ethyl 3-(p-acetamidoanilino)crotonate (CAS 7143-45-5) is a chemical compound with molecular formula C14H18N2O3 and molecular weight 262.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (E)-3-(4-acetamidoanilino)but-2-enoate
Also Known As: Ethyl 3-(p-acetamidoanilino)crotonate, BAS 00733525, ethyl (E)-3-(4-acetamidoanilino)but-2-enoate, J1.427.380H, J2.620.184E
| Molecular Formula | C14H18N2O3 |
|---|---|
| Molecular Weight | 262.13 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 262.13174 |
| Heavy Atoms | 19 |
| Complexity | 345.0 |
Chemical Identifiers
| CAS Number | 7143-45-5 |
|---|---|
| SMILES | CCOC(=O)/C=C(\C)/NC1=CC=C(C=C1)NC(=O)C |
| InChIKey | JBJTUFMRQIGTQN-MDZDMXLPSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 3-(p-acetamidoanilino)crotonate (CAS 7143-45-5), with molecular formula C14H18N2O3 and molecular weight 262.13 g/mol. IUPAC: ethyl (E)-3-(4-acetamidoanilino)but-2-enoate.
Chemical Property Profile of Ethyl 3-(p-acetamidoanilino)crotonate
Property Insights of Ethyl 3-(p-acetamidoanilino)crotonate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-(p-acetamidoanilino)crotonate. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-(p-acetamidoanilino)crotonate. Following Lipinski's Rule of Five, Ethyl 3-(p-acetamidoanilino)crotonate 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 3-(p-acetamidoanilino)crotonate?
The CAS number of Ethyl 3-(p-acetamidoanilino)crotonate is 7143-45-5.
What is the molecular formula of Ethyl 3-(p-acetamidoanilino)crotonate?
The molecular formula of Ethyl 3-(p-acetamidoanilino)crotonate is C14H18N2O3.
What is the molecular weight of Ethyl 3-(p-acetamidoanilino)crotonate?
The molecular weight of Ethyl 3-(p-acetamidoanilino)crotonate is 262.13 g/mol.
Where can I buy Ethyl 3-(p-acetamidoanilino)crotonate?
You can request a quote for Ethyl 3-(p-acetamidoanilino)crotonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-(p-acetamidoanilino)crotonate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-(p-acetamidoanilino)crotonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.