3-chloro-N-{11-[4-(propan-2-yl)piperazin-1-yl]dibenzo[b,f][1,4]oxazepin-2-yl}benzamide
Chemical Structure Depiction of
3-chloro-N-{11-[4-(propan-2-yl)piperazin-1-yl]dibenzo[b,f][1,4]oxazepin-2-yl}benzamide
3-chloro-N-{11-[4-(propan-2-yl)piperazin-1-yl]dibenzo[b,f][1,4]oxazepin-2-yl}benzamide
Compound characteristics
| Compound ID: | V023-8756 |
| Compound Name: | 3-chloro-N-{11-[4-(propan-2-yl)piperazin-1-yl]dibenzo[b,f][1,4]oxazepin-2-yl}benzamide |
| Molecular Weight: | 474.99 |
| Molecular Formula: | C27 H27 Cl N4 O2 |
| Salt: | not_available |
| Smiles: | CC(C)N1CCN(CC1)C1c2cc(ccc2Oc2ccccc2N=1)NC(c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2874 |
| logD: | 4.5736 |
| logSw: | -5.7554 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.217 |
| InChI Key: | ROUGFAUYUJTDBM-UHFFFAOYSA-N |