ChemDiv1_012106
TL;DR: ChemDiv1_012106 (CAS 361371-62-2) is a chemical compound with molecular formula C17H18ClF3N2O2 and molecular weight 374.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chlorophenyl)-[3-cyclohexyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone
Also Known As: ChemDiv1_012106, A2358/0099611, (2-chlorophenyl)-[3-cyclohexyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone, (2-chlorophenyl)[3-cyclohexyl-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone, 1-(2-CHLOROBENZOYL)-3-CYCLOHEXYL-5-(TRIFLUOROMETHYL)-4,5-DIHYDRO-1H-PYRAZOL-5-OL
| Molecular Formula | C17H18ClF3N2O2 |
|---|---|
| Molecular Weight | 374.10 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 374.1009 |
| Heavy Atoms | 25 |
| Complexity | 549.0 |
Chemical Identifiers
| CAS Number | 361371-62-2 |
|---|---|
| SMILES | C1CCC(CC1)C2=NN(C(C2)(C(F)(F)F)O)C(=O)C3=CC=CC=C3Cl |
| InChIKey | FJEIQJACCCSYNO-UHFFFAOYSA-N |
Product Overview
ChemDiv1_012106 (CAS 361371-62-2), with molecular formula C17H18ClF3N2O2 and molecular weight 374.10 g/mol. IUPAC: (2-chlorophenyl)-[3-cyclohexyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone.
Chemical Property Profile of ChemDiv1_012106
Property Insights of ChemDiv1_012106
The XLogP value of 4.8 indicates that ChemDiv1_012106 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.9 Ų, ChemDiv1_012106 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_012106 has 1 hydrogen bond donor(s) and 6 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_012106?
The CAS number of ChemDiv1_012106 is 361371-62-2.
What is the molecular formula of ChemDiv1_012106?
The molecular formula of ChemDiv1_012106 is C17H18ClF3N2O2.
What is the molecular weight of ChemDiv1_012106?
The molecular weight of ChemDiv1_012106 is 374.10 g/mol.
Where can I buy ChemDiv1_012106?
You can request a quote for ChemDiv1_012106 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_012106?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_012106 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.