2-(4-fluorophenyl)-1-{4-[8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepan-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-fluorophenyl)-1-{4-[8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepan-1-yl}ethan-1-one
2-(4-fluorophenyl)-1-{4-[8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepan-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V004-2469 |
| Compound Name: | 2-(4-fluorophenyl)-1-{4-[8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepan-1-yl}ethan-1-one |
| Molecular Weight: | 497.49 |
| Molecular Formula: | C27 H23 F4 N3 O2 |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)C(Cc1ccc(cc1)F)=O)C1c2ccccc2Oc2ccc(cc2N=1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.0574 |
| logD: | 4.0526 |
| logSw: | -4.9574 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.522 |
| InChI Key: | UOCREECEMPJYKH-UHFFFAOYSA-N |