4-[2-methyl-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-N-(propan-2-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-[2-methyl-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-N-(propan-2-yl)piperazine-1-carboxamide
4-[2-methyl-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-N-(propan-2-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V004-3821 |
| Compound Name: | 4-[2-methyl-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-N-(propan-2-yl)piperazine-1-carboxamide |
| Molecular Weight: | 446.47 |
| Molecular Formula: | C23 H25 F3 N4 O2 |
| Smiles: | CC(C)NC(N1CCN(CC1)C1c2cc(C)ccc2Oc2ccc(cc2N=1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4844 |
| logD: | 3.7858 |
| logSw: | -4.3613 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.107 |
| InChI Key: | SMSJXILQCQXDCY-UHFFFAOYSA-N |