3-[3-(3,4-dimethoxyphenyl)-4-[(1Z)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid
TL;DR: 3-[3-(3,4-dimethoxyphenyl)-4-[(1Z)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid (CAS 882229-97-2) is a chemical compound with molecular formula C24H24N2O6 and molecular weight 436.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(3,4-dimethoxyphenyl)-4-[(E)-3-(4-methoxyphenyl)-3-oxoprop-1-enyl]pyrazol-1-yl]propanoic acid
Also Known As: 3-[3-(3,4-dimethoxyphenyl)-4-[(1Z)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid, 3-[3-(3,4-dimethoxyphenyl)-4-[(E)-3-(4-methoxyphenyl)-3-oxoprop-1-enyl]pyrazol-1-yl]propanoic acid, 3-[3-(3,4-dimethoxyphenyl)-4-[3-(4-methoxyphenyl)-3-oxo-prop-1-enyl]pyrazol-1-yl]propanoic Acid
| Molecular Formula | C24H24N2O6 |
|---|---|
| Molecular Weight | 436.16 g/mol |
| LogP | 3.9467 |
| Topological Polar Surface Area | 99.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 436.16342 |
| Heavy Atoms | 32 |
| Complexity | 1131.8912 |
Chemical Identifiers
| CAS Number | 882229-97-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)/C=C/C2=CN(N=C2C3=CC(=C(C=C3)OC)OC)CCC(=O)O |
Product Overview
3-[3-(3,4-dimethoxyphenyl)-4-[(1Z)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid (CAS 882229-97-2), with molecular formula C24H24N2O6 and molecular weight 436.16 g/mol. IUPAC: 3-[3-(3,4-dimethoxyphenyl)-4-[(E)-3-(4-methoxyphenyl)-3-oxoprop-1-enyl]pyrazol-1-yl]propanoic acid.
Chemical Property Profile of 3-[3-(3,4-dimethoxyphenyl)-4-[(1Z)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid
Property Insights of 3-[3-(3,4-dimethoxyphenyl)-4-[(1Z)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid
The XLogP value of 3.9467 indicates that 3-[3-(3,4-dimethoxyphenyl)-4-[(1Z)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[3-(3,4-dimethoxyphenyl)-4-[(1Z)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid. Following Lipinski's Rule of Five, 3-[3-(3,4-dimethoxyphenyl)-4-[(1Z)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid has 1 hydrogen bond donor(s) and 6 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-[3-(3,4-dimethoxyphenyl)-4-[(1Z)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid?
The CAS number of 3-[3-(3,4-dimethoxyphenyl)-4-[(1Z)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid is 882229-97-2.
What is the molecular formula of 3-[3-(3,4-dimethoxyphenyl)-4-[(1Z)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid?
The molecular formula of 3-[3-(3,4-dimethoxyphenyl)-4-[(1Z)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid is C24H24N2O6.
What is the molecular weight of 3-[3-(3,4-dimethoxyphenyl)-4-[(1Z)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid?
The molecular weight of 3-[3-(3,4-dimethoxyphenyl)-4-[(1Z)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid is 436.16 g/mol.
Where can I buy 3-[3-(3,4-dimethoxyphenyl)-4-[(1Z)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid?
You can request a quote for 3-[3-(3,4-dimethoxyphenyl)-4-[(1Z)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[3-(3,4-dimethoxyphenyl)-4-[(1Z)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[3-(3,4-dimethoxyphenyl)-4-[(1Z)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.