4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-N-[(3-methylphenyl)methyl]-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-N-[(3-methylphenyl)methyl]-1,4-diazepane-1-carboxamide
4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-N-[(3-methylphenyl)methyl]-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V021-6905 |
| Compound Name: | 4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-N-[(3-methylphenyl)methyl]-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 538.57 |
| Molecular Formula: | C29 H29 F3 N4 O3 |
| Smiles: | Cc1cccc(CNC(N2CCCN(CC2)C2c3cc(ccc3Oc3ccc(cc3N=2)C(F)(F)F)OC)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.5591 |
| logD: | 3.9608 |
| logSw: | -5.452 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.736 |
| InChI Key: | USNLZKMONBWAFL-UHFFFAOYSA-N |