Methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate
TL;DR: Methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate (CAS 357155-86-3) is a chemical compound with molecular formula C18H16O4 and molecular weight 296.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate
Also Known As: UPCMLD0ENAT5685040:001, methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate, (R)-1-Boc-4-oxopiperidine-2-carboxylic acid ethyl ester, methyl 4-[(1E)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]benzoate, METHYL 4-[3-(4-METHOXYPHENYL)-3-OXOPROP-1-EN-1-YL]BENZOATE
| Molecular Formula | C18H16O4 |
|---|---|
| Molecular Weight | 296.10 g/mol |
| LogP | 3.3779 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 296.10486 |
| Heavy Atoms | 22 |
| Complexity | 682.03204 |
Chemical Identifiers
| CAS Number | 357155-86-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)C(=O)OC |
Product Overview
Methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate (CAS 357155-86-3), with molecular formula C18H16O4 and molecular weight 296.10 g/mol. IUPAC: methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate.
Chemical Property Profile of Methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate
Property Insights of Methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate
The XLogP value of 3.3779 indicates that Methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate 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 Methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate?
The CAS number of Methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate is 357155-86-3.
What is the molecular formula of Methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate?
The molecular formula of Methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate is C18H16O4.
What is the molecular weight of Methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate?
The molecular weight of Methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate is 296.10 g/mol.
Where can I buy Methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate?
You can request a quote for Methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-[3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.