[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-3,5-dimethyl-1H-pyrazol-1-yl][3-(trifluoromethyl)phenyl]methanone
Chemical Structure Depiction of
[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-3,5-dimethyl-1H-pyrazol-1-yl][3-(trifluoromethyl)phenyl]methanone
[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-3,5-dimethyl-1H-pyrazol-1-yl][3-(trifluoromethyl)phenyl]methanone
Compound characteristics
| Compound ID: | G680-0340 |
| Compound Name: | [4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-3,5-dimethyl-1H-pyrazol-1-yl][3-(trifluoromethyl)phenyl]methanone |
| Molecular Weight: | 463.48 |
| Molecular Formula: | C22 H20 F3 N3 O3 S |
| Smiles: | Cc1c(c(C)n(C(c2cccc(c2)C(F)(F)F)=O)n1)S(N1CCc2ccccc2C1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4059 |
| logD: | 3.4059 |
| logSw: | -3.8381 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.225 |
| InChI Key: | VOXQBVUTSOEQEE-UHFFFAOYSA-N |