6-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one
Chemical Structure Depiction of
6-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one
6-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one
Compound characteristics
| Compound ID: | E645-0251 |
| Compound Name: | 6-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one |
| Molecular Weight: | 448.91 |
| Molecular Formula: | C24 H21 Cl N4 O3 |
| Smiles: | C1CN(CCN1C(CN1C(c2cccnc2Oc2ccccc12)=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.4576 |
| logD: | 3.4575 |
| logSw: | -3.9133 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.185 |
| InChI Key: | MKWRBHXIWFVZBW-UHFFFAOYSA-N |