1-(5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl)-2-[4-(trifluoromethoxy)phenyl]ethan-1-one
Chemical Structure Depiction of
1-(5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl)-2-[4-(trifluoromethoxy)phenyl]ethan-1-one
1-(5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl)-2-[4-(trifluoromethoxy)phenyl]ethan-1-one
Compound characteristics
| Compound ID: | T599-3186 |
| Compound Name: | 1-(5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl)-2-[4-(trifluoromethoxy)phenyl]ethan-1-one |
| Molecular Weight: | 364.37 |
| Molecular Formula: | C19 H19 F3 N2 O2 |
| Smiles: | CN1CCCN(C(Cc2ccc(cc2)OC(F)(F)F)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.2224 |
| logD: | 4.2222 |
| logSw: | -4.3149 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 23.9205 |
| InChI Key: | JRKUZYFSWIDONQ-UHFFFAOYSA-N |