8-chloro-6-[4-oxo-4-(pyrrolidin-1-yl)butyl]pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one
Chemical Structure Depiction of
8-chloro-6-[4-oxo-4-(pyrrolidin-1-yl)butyl]pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one
8-chloro-6-[4-oxo-4-(pyrrolidin-1-yl)butyl]pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one
Compound characteristics
| Compound ID: | E645-2650 |
| Compound Name: | 8-chloro-6-[4-oxo-4-(pyrrolidin-1-yl)butyl]pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one |
| Molecular Weight: | 385.85 |
| Molecular Formula: | C20 H20 Cl N3 O3 |
| Smiles: | C1CCN(C1)C(CCCN1C(c2cccnc2Oc2ccc(cc12)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8031 |
| logD: | 2.8031 |
| logSw: | -3.7292 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.269 |
| InChI Key: | YNVBTMVDXQFYNV-UHFFFAOYSA-N |