N-(3,4-difluorophenyl)-4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-2-methylpiperazine-1-carboxamide
Chemical Structure Depiction of
N-(3,4-difluorophenyl)-4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-2-methylpiperazine-1-carboxamide
N-(3,4-difluorophenyl)-4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-2-methylpiperazine-1-carboxamide
Compound characteristics
| Compound ID: | V021-6893 |
| Compound Name: | N-(3,4-difluorophenyl)-4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-2-methylpiperazine-1-carboxamide |
| Molecular Weight: | 546.5 |
| Molecular Formula: | C27 H23 F5 N4 O3 |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1C(Nc1ccc(c(c1)F)F)=O)C1c2cc(ccc2Oc2ccc(cc2N=1)C(F)(F)F)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.72 |
| logD: | 4.7879 |
| logSw: | -5.5008 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.301 |
| InChI Key: | AOTYLTJVWARCDF-HNNXBMFYSA-N |