BAS 08949924
TL;DR: BAS 08949924 (CAS 708990-99-2) is a chemical compound with molecular formula C13H12ClF3N2O2 and molecular weight 320.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chloro-4-methylphenyl)-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone
Also Known As: BAS 08949924, (2-chloro-4-methylphenyl)-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone, (2-chloro-4-methylphenyl)[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone
| Molecular Formula | C13H12ClF3N2O2 |
|---|---|
| Molecular Weight | 320.05 g/mol |
| LogP | 3.12112 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 320.05392 |
| Heavy Atoms | 21 |
| Complexity | 630.33264 |
Chemical Identifiers
| CAS Number | 708990-99-2 |
|---|---|
| SMILES | CC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=C(C=C(C=C2)C)Cl |
Product Overview
BAS 08949924 (CAS 708990-99-2), with molecular formula C13H12ClF3N2O2 and molecular weight 320.05 g/mol. IUPAC: (2-chloro-4-methylphenyl)-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone.
Chemical Property Profile of BAS 08949924
Property Insights of BAS 08949924
The XLogP value of 3.12112 indicates that BAS 08949924 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.9 Ų, BAS 08949924 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 08949924 has 1 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 BAS 08949924?
The CAS number of BAS 08949924 is 708990-99-2.
What is the molecular formula of BAS 08949924?
The molecular formula of BAS 08949924 is C13H12ClF3N2O2.
What is the molecular weight of BAS 08949924?
The molecular weight of BAS 08949924 is 320.05 g/mol.
Where can I buy BAS 08949924?
You can request a quote for BAS 08949924 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 08949924?
Yes, KEHONG BIO provides custom synthesis services for BAS 08949924 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.