(Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid
TL;DR: (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid (CAS 143945-86-2) is a chemical compound with molecular formula C13H12N2O2 and molecular weight 228.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid
Also Known As: Cis-Ozagrel, (Z)-Ozagrel, Ozagrel [INN], Ozagrel Impurity 6, Ozagrel (Z)-Isomer
| Molecular Formula | C13H12N2O2 |
|---|---|
| Molecular Weight | 228.09 g/mol |
| LogP | 2.0292 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 228.08987 |
| Heavy Atoms | 17 |
| Complexity | 512.8623 |
Chemical Identifiers
| CAS Number | 143945-86-2 |
|---|---|
| SMILES | C1=CC(=CC=C1CN2C=CN=C2)/C=C\C(=O)O |
Product Overview
(Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid (CAS 143945-86-2), with molecular formula C13H12N2O2 and molecular weight 228.09 g/mol. IUPAC: (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid.
Chemical Property Profile of (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid
Property Insights of (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid
The XLogP value of 2.0292 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid. With a topological polar surface area (TPSA) of 55.12 Ų, (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid has 1 hydrogen bond donor(s) and 2 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 (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid?
The CAS number of (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid is 143945-86-2.
What is the molecular formula of (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid?
The molecular formula of (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid is C13H12N2O2.
What is the molecular weight of (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid?
The molecular weight of (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid is 228.09 g/mol.
Where can I buy (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid?
You can request a quote for (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.