ChemDiv1_004750
TL;DR: ChemDiv1_004750 (CAS 394239-62-4) is a chemical compound with molecular formula C22H24N2O5 and molecular weight 396.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[3-(3,4-dimethoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid
Also Known As: ChemDiv1_004750, US10774063, Compound a, BAS 02072371, 5-[5-(3,4-dimethoxyphenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoic acid, 5-[5-(3,4-dimethoxyphenyl)-3-phenyl(2-pyrazolinyl)]-5-oxopentanoic acid
| Molecular Formula | C22H24N2O5 |
|---|---|
| Molecular Weight | 396.17 g/mol |
| LogP | 3.6364 |
| Topological Polar Surface Area | 88.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 396.16852 |
| Heavy Atoms | 29 |
| Complexity | 910.6736 |
Chemical Identifiers
| CAS Number | 394239-62-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2CC(=NN2C(=O)CCCC(=O)O)C3=CC=CC=C3)OC |
Product Overview
ChemDiv1_004750 (CAS 394239-62-4), with molecular formula C22H24N2O5 and molecular weight 396.17 g/mol. IUPAC: 5-[3-(3,4-dimethoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid.
Chemical Property Profile of ChemDiv1_004750
Property Insights of ChemDiv1_004750
The XLogP value of 3.6364 indicates that ChemDiv1_004750 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.43 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_004750. Following Lipinski's Rule of Five, ChemDiv1_004750 has 1 hydrogen bond donor(s) and 5 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_004750?
The CAS number of ChemDiv1_004750 is 394239-62-4.
What is the molecular formula of ChemDiv1_004750?
The molecular formula of ChemDiv1_004750 is C22H24N2O5.
What is the molecular weight of ChemDiv1_004750?
The molecular weight of ChemDiv1_004750 is 396.17 g/mol.
Where can I buy ChemDiv1_004750?
You can request a quote for ChemDiv1_004750 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_004750?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_004750 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.