Opera_ID_48
TL;DR: Opera_ID_48 (CAS 1164544-90-4) is a chemical compound with molecular formula C26H24O7 and molecular weight 448.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-3-(4-methoxyphenyl)-3-oxoprop-1-enyl]phenyl] 3,4,5-trimethoxybenzoate
Also Known As: (E)-4-(3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl)phenyl 3,4,5-trimethoxybenzoate, [4-[(E)-3-(4-methoxyphenyl)-3-oxoprop-1-enyl]phenyl] 3,4,5-trimethoxybenzoate, 3,4,5-Trimethoxy-benzoic acid 4-[(E)-3-(4-methoxy-phenyl)-3-oxo-propenyl]-phenyl ester, 4-[(1E)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]phenyl 3,4,5-trimethoxybenzoate, 4-[(1E)-3-(4-methoxyphenyl)-3-oxoprop-1-enyl]phenyl 3,4,5-trimethoxybenzoate
| Molecular Formula | C26H24O7 |
|---|---|
| Molecular Weight | 448.15 g/mol |
| LogP | 4.8363 |
| Topological Polar Surface Area | 80.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 448.1522 |
| Heavy Atoms | 33 |
| Complexity | 1121.2579 |
Chemical Identifiers
| CAS Number | 1164544-90-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)/C=C/C2=CC=C(C=C2)OC(=O)C3=CC(=C(C(=C3)OC)OC)OC |
Product Overview
Opera_ID_48 (CAS 1164544-90-4), with molecular formula C26H24O7 and molecular weight 448.15 g/mol. IUPAC: [4-[(E)-3-(4-methoxyphenyl)-3-oxoprop-1-enyl]phenyl] 3,4,5-trimethoxybenzoate.
Chemical Property Profile of Opera_ID_48
Property Insights of Opera_ID_48
The XLogP value of 4.8363 indicates that Opera_ID_48 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.29 Ų falls within the moderate polarity range, balancing permeability and solubility for Opera_ID_48. Following Lipinski's Rule of Five, Opera_ID_48 has 0 hydrogen bond donor(s) and 7 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 Opera_ID_48?
The CAS number of Opera_ID_48 is 1164544-90-4.
What is the molecular formula of Opera_ID_48?
The molecular formula of Opera_ID_48 is C26H24O7.
What is the molecular weight of Opera_ID_48?
The molecular weight of Opera_ID_48 is 448.15 g/mol.
Where can I buy Opera_ID_48?
You can request a quote for Opera_ID_48 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Opera_ID_48?
Yes, KEHONG BIO provides custom synthesis services for Opera_ID_48 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.