BAS 00341634
TL;DR: BAS 00341634 (CAS 331238-84-7) is a chemical compound with molecular formula C15H16BrF3N2O2 and molecular weight 392.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-bromophenyl)-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]methanone
Also Known As: BAS 00341634, (3-bromophenyl)-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]methanone, 1-(3-bromobenzoyl)-5-tert-butyl-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol, (3-bromophenyl)(5-(tert-butyl)-5-hydroxy-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl)methanone, (3-bromophenyl)[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone
| Molecular Formula | C15H16BrF3N2O2 |
|---|---|
| Molecular Weight | 392.03 g/mol |
| LogP | 3.948 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 392.03473 |
| Heavy Atoms | 23 |
| Complexity | 667.4212 |
Chemical Identifiers
| CAS Number | 331238-84-7 |
|---|---|
| SMILES | CC(C)(C)C1(CC(=NN1C(=O)C2=CC(=CC=C2)Br)C(F)(F)F)O |
Product Overview
BAS 00341634 (CAS 331238-84-7), with molecular formula C15H16BrF3N2O2 and molecular weight 392.03 g/mol. IUPAC: (3-bromophenyl)-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]methanone.
Chemical Property Profile of BAS 00341634
Property Insights of BAS 00341634
The XLogP value of 3.948 indicates that BAS 00341634 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 00341634 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00341634 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 00341634?
The CAS number of BAS 00341634 is 331238-84-7.
What is the molecular formula of BAS 00341634?
The molecular formula of BAS 00341634 is C15H16BrF3N2O2.
What is the molecular weight of BAS 00341634?
The molecular weight of BAS 00341634 is 392.03 g/mol.
Where can I buy BAS 00341634?
You can request a quote for BAS 00341634 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00341634?
Yes, KEHONG BIO provides custom synthesis services for BAS 00341634 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.