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Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)acrylate
TL;DR: Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)acrylate (CAS 1164529-79-6) is a chemical compound with molecular formula C18H16Cl2N2O4 and molecular weight 394.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (E)-2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)prop-2-enoate
Also Known As: methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)acrylate, methyl (E)-2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)prop-2-enoate, methyl (2E)-2-[(2,4-dichlorophenyl)formamido]-3-[(4-methoxyphenyl)amino]prop-2-enoate, methyl(2E)-2-[(2,4-dichlorophenyl)formamido]-3-[(4-methoxyphenyl)amino]prop-2-enoate
| Molecular Formula | C18H16Cl2N2O4 |
|---|---|
| Molecular Weight | 394.05 g/mol |
| LogP | 3.8583 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 394.0487 |
| Heavy Atoms | 26 |
| Complexity | 835.5848 |
Chemical Identifiers
| CAS Number | 1164529-79-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N/C=C(\C(=O)OC)/NC(=O)C2=C(C=C(C=C2)Cl)Cl |
Product Overview
Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)acrylate (CAS 1164529-79-6), with molecular formula C18H16Cl2N2O4 and molecular weight 394.05 g/mol. IUPAC: methyl (E)-2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)prop-2-enoate.
Chemical Property Profile of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)acrylate
Property Insights of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)acrylate
The XLogP value of 3.8583 indicates that Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)acrylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)acrylate. Following Lipinski's Rule of Five, Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)acrylate has 2 hydrogen bond donor(s) and 5 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-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)acrylate?
The CAS number of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)acrylate is 1164529-79-6.
What is the molecular formula of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)acrylate?
The molecular formula of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)acrylate is C18H16Cl2N2O4.
What is the molecular weight of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)acrylate?
The molecular weight of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)acrylate is 394.05 g/mol.
Where can I buy Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)acrylate?
You can request a quote for Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)acrylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(4-methoxyanilino)acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.