BAS 00341628
TL;DR: BAS 00341628 (CAS 331238-81-4) is a chemical compound with molecular formula C9H13F3N2O2 and molecular weight 238.09291 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-methylpropan-1-one
Also Known As: BAS 00341628, AB00084241-01, 1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-methylpropan-1-one, 1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-methylpropan-1-one, 1-[5-hydroxy-3-methyl-5-(trifluoromethyl)(2-pyrazolinyl)]-2-methylpropan-1-one
Technical Specifications
| Molecular Formula | C9H13F3N2O2 |
| Molecular Weight | 238.09291 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 238.09291 Da |
| Heavy Atoms | 16 |
| Complexity | 338.0 |
| SMILES | CC1=NN(C(C1)(C(F)(F)F)O)C(=O)C(C)C |
| InChIKey | OAYOZAPGZYQDSW-UHFFFAOYSA-N |
Chemical Property Profile of BAS 00341628
Property Insights of BAS 00341628
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00341628. With a topological polar surface area (TPSA) of 52.9 Ų, BAS 00341628 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00341628 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
What is the CAS number of BAS 00341628?
The CAS number of BAS 00341628 is 331238-81-4.
What is the molecular formula of BAS 00341628?
The molecular formula of BAS 00341628 is C9H13F3N2O2.
What is the molecular weight of BAS 00341628?
The molecular weight of BAS 00341628 is 238.09291 g/mol.
Where can I buy BAS 00341628?
You can request a quote for BAS 00341628 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BAS 00341628?
Yes, CoreyChem provides custom synthesis services for BAS 00341628 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.