ChemDiv1_008684
TL;DR: ChemDiv1_008684 (CAS 402951-35-3) is a chemical compound with molecular formula C22H18FN3O and molecular weight 359.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(2-fluorophenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-pyridin-3-ylmethanone
Also Known As: ChemDiv1_008684, F0877-0163, 3-[5-(2-fluorophenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazole-1-carbonyl]pyridine, (5-(2-fluorophenyl)-3-(p-tolyl)-4,5-dihydro-1H-pyrazol-1-yl)(pyridin-3-yl)methanone, [3-(2-fluorophenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-pyridin-3-ylmethanone
| Molecular Formula | C22H18FN3O |
|---|---|
| Molecular Weight | 359.14 g/mol |
| LogP | 4.52062 |
| Topological Polar Surface Area | 45.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 359.1434 |
| Heavy Atoms | 27 |
| Complexity | 999.5812 |
Chemical Identifiers
| CAS Number | 402951-35-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=CC=C3F)C(=O)C4=CN=CC=C4 |
Product Overview
ChemDiv1_008684 (CAS 402951-35-3), with molecular formula C22H18FN3O and molecular weight 359.14 g/mol. IUPAC: [3-(2-fluorophenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-pyridin-3-ylmethanone.
Chemical Property Profile of ChemDiv1_008684
Property Insights of ChemDiv1_008684
The XLogP value of 4.52062 indicates that ChemDiv1_008684 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.56 Ų, ChemDiv1_008684 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_008684 has 0 hydrogen bond donor(s) and 3 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_008684?
The CAS number of ChemDiv1_008684 is 402951-35-3.
What is the molecular formula of ChemDiv1_008684?
The molecular formula of ChemDiv1_008684 is C22H18FN3O.
What is the molecular weight of ChemDiv1_008684?
The molecular weight of ChemDiv1_008684 is 359.14 g/mol.
Where can I buy ChemDiv1_008684?
You can request a quote for ChemDiv1_008684 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_008684?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_008684 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.