ChemDiv1_007262
TL;DR: ChemDiv1_007262 (CAS 362490-68-4) is a chemical compound with molecular formula C21H22N2O4 and molecular weight 366.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[5-(4-methoxyphenyl)-3-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid
Also Known As: ChemDiv1_007262, BIM-0031516.P001, 4-[3-(4-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid, 4-[5-(4-methoxyphenyl)-3-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid, 4-(3-(4-methoxyphenyl)-5-(p-tolyl)-4,5-dihydro-1H-pyrazol-1-yl)-4-oxobutanoic acid
| Molecular Formula | C21H22N2O4 |
|---|---|
| Molecular Weight | 366.16 g/mol |
| LogP | 3.54612 |
| Topological Polar Surface Area | 79.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 366.15796 |
| Heavy Atoms | 27 |
| Complexity | 856.75525 |
Chemical Identifiers
| CAS Number | 362490-68-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2CC(=NN2C(=O)CCC(=O)O)C3=CC=C(C=C3)OC |
Product Overview
ChemDiv1_007262 (CAS 362490-68-4), with molecular formula C21H22N2O4 and molecular weight 366.16 g/mol. IUPAC: 4-[5-(4-methoxyphenyl)-3-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid.
Chemical Property Profile of ChemDiv1_007262
Property Insights of ChemDiv1_007262
The XLogP value of 3.54612 indicates that ChemDiv1_007262 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.2 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_007262. Following Lipinski's Rule of Five, ChemDiv1_007262 has 1 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 ChemDiv1_007262?
The CAS number of ChemDiv1_007262 is 362490-68-4.
What is the molecular formula of ChemDiv1_007262?
The molecular formula of ChemDiv1_007262 is C21H22N2O4.
What is the molecular weight of ChemDiv1_007262?
The molecular weight of ChemDiv1_007262 is 366.16 g/mol.
Where can I buy ChemDiv1_007262?
You can request a quote for ChemDiv1_007262 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_007262?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_007262 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.