N-(4-fluorophenyl)-4-[7-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-4-[7-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepane-1-carboxamide
N-(4-fluorophenyl)-4-[7-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V004-3735 |
| Compound Name: | N-(4-fluorophenyl)-4-[7-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 498.48 |
| Molecular Formula: | C26 H22 F4 N4 O2 |
| Smiles: | C1CN(CCN(C1)C(Nc1ccc(cc1)F)=O)C1c2ccccc2Oc2cc(ccc2N=1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.2142 |
| logD: | 4.112 |
| logSw: | -5.4399 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.87 |
| InChI Key: | PQXSQXKMDJSCNE-UHFFFAOYSA-N |