![methyl (2E)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoate structure](/static/products/423/423724-52-1.png)
methyl (2E)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoate
TL;DR: methyl (2E)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoate (CAS 423724-52-1) is a chemical compound with molecular formula C18H16BrNO3 and molecular weight 373.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (E)-2-(4-bromoanilino)-4-(4-methylphenyl)-4-oxobut-2-enoate
Also Known As: (E)-methyl 2-((4-bromophenyl)amino)-4-oxo-4-(p-tolyl)but-2-enoate, methyl (E)-2-(4-bromoanilino)-4-(4-methylphenyl)-4-oxobut-2-enoate, methyl (2E)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoate
| Molecular Formula | C18H16BrNO3 |
|---|---|
| Molecular Weight | 373.03 g/mol |
| LogP | 4.10922 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.03137 |
| Heavy Atoms | 23 |
| Complexity | 733.86694 |
Chemical Identifiers
| CAS Number | 423724-52-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)/C=C(\C(=O)OC)/NC2=CC=C(C=C2)Br |
Product Overview
methyl (2E)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoate (CAS 423724-52-1), with molecular formula C18H16BrNO3 and molecular weight 373.03 g/mol. IUPAC: methyl (E)-2-(4-bromoanilino)-4-(4-methylphenyl)-4-oxobut-2-enoate.
Chemical Property Profile of methyl (2E)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoate
Property Insights of methyl (2E)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoate
The XLogP value of 4.10922 indicates that methyl (2E)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, methyl (2E)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl (2E)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoate has 1 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 methyl (2E)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoate?
The CAS number of methyl (2E)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoate is 423724-52-1.
What is the molecular formula of methyl (2E)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoate?
The molecular formula of methyl (2E)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoate is C18H16BrNO3.
What is the molecular weight of methyl (2E)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoate?
The molecular weight of methyl (2E)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoate is 373.03 g/mol.
Where can I buy methyl (2E)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoate?
You can request a quote for methyl (2E)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-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)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for methyl (2E)-2-[(4-bromophenyl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.