4-(3,4-dichlorophenyl)-4,5-dihydro-1,4-benzoxazepin-3(2H)-one
Chemical Structure Depiction of
4-(3,4-dichlorophenyl)-4,5-dihydro-1,4-benzoxazepin-3(2H)-one
4-(3,4-dichlorophenyl)-4,5-dihydro-1,4-benzoxazepin-3(2H)-one
Compound characteristics
| Compound ID: | 8014-1644 |
| Compound Name: | 4-(3,4-dichlorophenyl)-4,5-dihydro-1,4-benzoxazepin-3(2H)-one |
| Molecular Weight: | 308.16 |
| Molecular Formula: | C15 H11 Cl2 N O2 |
| Smiles: | C1c2ccccc2OCC(N1c1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.049 |
| logD: | 4.049 |
| logSw: | -4.2689 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.1312 |
| InChI Key: | RYERMBUTEZEAFI-UHFFFAOYSA-N |