2-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-[(thiophen-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-[(thiophen-2-yl)methyl]acetamide
2-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-[(thiophen-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | E645-0750 |
| Compound Name: | 2-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-[(thiophen-2-yl)methyl]acetamide |
| Molecular Weight: | 399.85 |
| Molecular Formula: | C19 H14 Cl N3 O3 S |
| Smiles: | C(c1cccs1)NC(CN1C(c2cccnc2Oc2ccc(cc12)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3457 |
| logD: | 3.3457 |
| logSw: | -3.8999 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.022 |
| InChI Key: | JNNRXZMSWRSAPS-UHFFFAOYSA-N |