N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide
TL;DR: N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide (CAS 301320-21-8) is a chemical compound with molecular formula C16H15F6N3O2 and molecular weight 395.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide
Also Known As: N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide, N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide #, N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide, Propanamide, 2,2-bis(trifluoromethyl)-N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-
| Molecular Formula | C16H15F6N3O2 |
|---|---|
| Molecular Weight | 395.11 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 52.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 395.10684 |
| Heavy Atoms | 27 |
| Complexity | 636.0 |
Chemical Identifiers
| CAS Number | 301320-21-8 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(C)(C(F)(F)F)C(F)(F)F |
| InChIKey | WTBOKIMHUAUHOD-UHFFFAOYSA-N |
Product Overview
N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide (CAS 301320-21-8), with molecular formula C16H15F6N3O2 and molecular weight 395.11 g/mol. IUPAC: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide.
Chemical Property Profile of N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide
Property Insights of N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide. With a topological polar surface area (TPSA) of 52.7 Ų, N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide has 1 hydrogen bond donor(s) and 9 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 N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide?
The CAS number of N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide is 301320-21-8.
What is the molecular formula of N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide?
The molecular formula of N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide is C16H15F6N3O2.
What is the molecular weight of N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide?
The molecular weight of N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide is 395.11 g/mol.
Where can I buy N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide?
You can request a quote for N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.