[[3-(4-Bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate
TL;DR: [[3-(4-Bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate (CAS 303151-51-1) 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.
[[3-(4-bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate
Also Known As: Bionet1_001307, [[3-(4-bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate, 1-(4-bromophenyl)-3-{methyl[(4-methylbenzoyl)oxy]amino}-2-propen-1-one
| Molecular Formula | C18H16BrNO3 |
|---|---|
| Molecular Weight | 373.03 g/mol |
| LogP | 4.15772 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.03137 |
| Heavy Atoms | 23 |
| Complexity | 720.9368 |
Chemical Identifiers
| CAS Number | 303151-51-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)ON(C)C=CC(=O)C2=CC=C(C=C2)Br |
Product Overview
[[3-(4-Bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate (CAS 303151-51-1), with molecular formula C18H16BrNO3 and molecular weight 373.03 g/mol. IUPAC: [[3-(4-bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate.
Chemical Property Profile of [[3-(4-Bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate
Property Insights of [[3-(4-Bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate
The XLogP value of 4.15772 indicates that [[3-(4-Bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, [[3-(4-Bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [[3-(4-Bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate has 0 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 [[3-(4-Bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate?
The CAS number of [[3-(4-Bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate is 303151-51-1.
What is the molecular formula of [[3-(4-Bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate?
The molecular formula of [[3-(4-Bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate is C18H16BrNO3.
What is the molecular weight of [[3-(4-Bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate?
The molecular weight of [[3-(4-Bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate is 373.03 g/mol.
Where can I buy [[3-(4-Bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate?
You can request a quote for [[3-(4-Bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [[3-(4-Bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for [[3-(4-Bromophenyl)-3-oxoprop-1-enyl]-methylamino] 4-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.