N-(3-chlorophenyl)-4-(2-methoxy-7-methyldibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-4-(2-methoxy-7-methyldibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepane-1-carboxamide
N-(3-chlorophenyl)-4-(2-methoxy-7-methyldibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V005-5271 |
| Compound Name: | N-(3-chlorophenyl)-4-(2-methoxy-7-methyldibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 490.99 |
| Molecular Formula: | C27 H27 Cl N4 O3 |
| Smiles: | Cc1ccc2c(c1)Oc1ccc(cc1C(=N2)N1CCCN(CC1)C(Nc1cccc(c1)[Cl])=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.6705 |
| logD: | 3.9676 |
| logSw: | -5.7786 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.414 |
| InChI Key: | XHCRQBVMGHRRCK-UHFFFAOYSA-N |