(5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl)[2-(trifluoromethoxy)phenyl]methanone
Chemical Structure Depiction of
(5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl)[2-(trifluoromethoxy)phenyl]methanone
(5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl)[2-(trifluoromethoxy)phenyl]methanone
Compound characteristics
| Compound ID: | T599-3158 |
| Compound Name: | (5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl)[2-(trifluoromethoxy)phenyl]methanone |
| Molecular Weight: | 350.34 |
| Molecular Formula: | C18 H17 F3 N2 O2 |
| Smiles: | CN1CCCN(C(c2ccccc2OC(F)(F)F)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.0091 |
| logD: | 4.0091 |
| logSw: | -4.3018 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.5345 |
| InChI Key: | VGRQBJVXULUOQT-UHFFFAOYSA-N |