N-benzyl-4-[2-methyl-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-benzyl-4-[2-methyl-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazine-1-carboxamide
N-benzyl-4-[2-methyl-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V003-9428 |
| Compound Name: | N-benzyl-4-[2-methyl-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazine-1-carboxamide |
| Molecular Weight: | 494.52 |
| Molecular Formula: | C27 H25 F3 N4 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccc2c(c1)C(=Nc1cc(ccc1O2)C(F)(F)F)N1CCN(CC1)C(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8935 |
| logD: | 4.1949 |
| logSw: | -4.6238 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.861 |
| InChI Key: | KBNPNMCYYIXSGL-UHFFFAOYSA-N |