N-[3-(2H-1,3-benzodioxol-5-yl)-5-(2-methylpropyl)-1H-pyrazol-4-yl]-4-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-[3-(2H-1,3-benzodioxol-5-yl)-5-(2-methylpropyl)-1H-pyrazol-4-yl]-4-(trifluoromethyl)benzamide
N-[3-(2H-1,3-benzodioxol-5-yl)-5-(2-methylpropyl)-1H-pyrazol-4-yl]-4-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V005-6304 |
| Compound Name: | N-[3-(2H-1,3-benzodioxol-5-yl)-5-(2-methylpropyl)-1H-pyrazol-4-yl]-4-(trifluoromethyl)benzamide |
| Molecular Weight: | 431.41 |
| Molecular Formula: | C22 H20 F3 N3 O3 |
| Salt: | not_available |
| Smiles: | CC(C)Cc1c(c(c2ccc3c(c2)OCO3)n[nH]1)NC(c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8025 |
| logD: | 4.8024 |
| logSw: | -4.5118 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.575 |
| InChI Key: | KSDRZDDEMGXMQJ-UHFFFAOYSA-N |