ChemDiv1_001146
TL;DR: ChemDiv1_001146 (CAS 331944-69-5) is a chemical compound with molecular formula C25H21N3O3 and molecular weight 411.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[5-(4-methoxyphenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]methyl]indole-2,3-dione
Also Known As: ChemDiv1_001146, BIM-0034211.P001, 1-((3-(4-methoxyphenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl)methyl)indoline-2,3-dione, 1-{[3-(4-methoxyphenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl]methyl}-2,3-dihydro-1H-indole-2,3-dione, F0477-0009
| Molecular Formula | C25H21N3O3 |
|---|---|
| Molecular Weight | 411.16 g/mol |
| LogP | 4.0333 |
| Topological Polar Surface Area | 62.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.1583 |
| Heavy Atoms | 31 |
| Complexity | 1172.1313 |
Chemical Identifiers
| CAS Number | 331944-69-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=CC=C3)CN4C5=CC=CC=C5C(=O)C4=O |
Product Overview
ChemDiv1_001146 (CAS 331944-69-5), with molecular formula C25H21N3O3 and molecular weight 411.16 g/mol. IUPAC: 1-[[5-(4-methoxyphenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]methyl]indole-2,3-dione.
Chemical Property Profile of ChemDiv1_001146
Property Insights of ChemDiv1_001146
The XLogP value of 4.0333 indicates that ChemDiv1_001146 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.21 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_001146. Following Lipinski's Rule of Five, ChemDiv1_001146 has 0 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_001146?
The CAS number of ChemDiv1_001146 is 331944-69-5.
What is the molecular formula of ChemDiv1_001146?
The molecular formula of ChemDiv1_001146 is C25H21N3O3.
What is the molecular weight of ChemDiv1_001146?
The molecular weight of ChemDiv1_001146 is 411.16 g/mol.
Where can I buy ChemDiv1_001146?
You can request a quote for ChemDiv1_001146 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_001146?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_001146 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.