ChemDiv1_023298
TL;DR: ChemDiv1_023298 (CAS 441313-97-9) is a chemical compound with molecular formula C24H17FN4O3 and molecular weight 428.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-fluorophenyl)-3-(4-methylphenyl)-4-(2-nitrophenyl)-1,4-dihydropyrrolo[3,4-d]pyrazol-6-one
Also Known As: ChemDiv1_023298, 5-(4-fluorophenyl)-3-(4-methylphenyl)-4-(2-nitrophenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one, 5-(4-fluorophenyl)-3-(4-methylphenyl)-4-(2-nitrophenyl)-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one, 5-(4-FLUOROPHENYL)-3-(4-METHYLPHENYL)-4-(2-NITROPHENYL)-1H,4H,5H,6H-PYRROLO[3,4-C]PYRAZOL-6-ONE, 5-(4-fluorophenyl)-4-(2-nitrophenyl)-3-(p-tolyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
| Molecular Formula | C24H17FN4O3 |
|---|---|
| Molecular Weight | 428.13 g/mol |
| LogP | 5.18222 |
| Topological Polar Surface Area | 92.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 428.12848 |
| Heavy Atoms | 32 |
| Complexity | 1346.6843 |
Chemical Identifiers
| CAS Number | 441313-97-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NNC3=C2C(N(C3=O)C4=CC=C(C=C4)F)C5=CC=CC=C5[N+](=O)[O-] |
Product Overview
ChemDiv1_023298 (CAS 441313-97-9), with molecular formula C24H17FN4O3 and molecular weight 428.13 g/mol. IUPAC: 5-(4-fluorophenyl)-3-(4-methylphenyl)-4-(2-nitrophenyl)-1,4-dihydropyrrolo[3,4-d]pyrazol-6-one.
Chemical Property Profile of ChemDiv1_023298
Property Insights of ChemDiv1_023298
The XLogP value of 5.18222 indicates that ChemDiv1_023298 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.13 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_023298. Following Lipinski's Rule of Five, ChemDiv1_023298 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_023298?
The CAS number of ChemDiv1_023298 is 441313-97-9.
What is the molecular formula of ChemDiv1_023298?
The molecular formula of ChemDiv1_023298 is C24H17FN4O3.
What is the molecular weight of ChemDiv1_023298?
The molecular weight of ChemDiv1_023298 is 428.13 g/mol.
Where can I buy ChemDiv1_023298?
You can request a quote for ChemDiv1_023298 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_023298?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_023298 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.