methyl (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-4-oxobut-2-enoate
TL;DR: methyl (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-4-oxobut-2-enoate (CAS 423724-55-4) is a chemical compound with molecular formula C18H16ClNO4 and molecular weight 345.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (E)-4-(4-chlorophenyl)-2-(4-methoxyanilino)-4-oxobut-2-enoate
Also Known As: methyl (E)-4-(4-chlorophenyl)-2-(4-methoxyanilino)-4-oxobut-2-enoate, (E)-methyl 4-(4-chlorophenyl)-2-((4-methoxyphenyl)amino)-4-oxobut-2-enoate, methyl (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-4-oxobut-2-enoate
| Molecular Formula | C18H16ClNO4 |
|---|---|
| Molecular Weight | 345.08 g/mol |
| LogP | 3.7003 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 345.07678 |
| Heavy Atoms | 24 |
| Complexity | 751.59314 |
Chemical Identifiers
| CAS Number | 423724-55-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N/C(=C/C(=O)C2=CC=C(C=C2)Cl)/C(=O)OC |
Product Overview
methyl (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-4-oxobut-2-enoate (CAS 423724-55-4), with molecular formula C18H16ClNO4 and molecular weight 345.08 g/mol. IUPAC: methyl (E)-4-(4-chlorophenyl)-2-(4-methoxyanilino)-4-oxobut-2-enoate.
Chemical Property Profile of methyl (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-4-oxobut-2-enoate
Property Insights of methyl (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-4-oxobut-2-enoate
The XLogP value of 3.7003 indicates that methyl (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-4-oxobut-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-4-oxobut-2-enoate. Following Lipinski's Rule of Five, methyl (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-4-oxobut-2-enoate has 1 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 (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-4-oxobut-2-enoate?
The CAS number of methyl (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-4-oxobut-2-enoate is 423724-55-4.
What is the molecular formula of methyl (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-4-oxobut-2-enoate?
The molecular formula of methyl (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-4-oxobut-2-enoate is C18H16ClNO4.
What is the molecular weight of methyl (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-4-oxobut-2-enoate?
The molecular weight of methyl (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-4-oxobut-2-enoate is 345.08 g/mol.
Where can I buy methyl (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-4-oxobut-2-enoate?
You can request a quote for methyl (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-4-oxobut-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 (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-4-oxobut-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for methyl (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-4-oxobut-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.