2-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}acetamide
Chemical Structure Depiction of
2-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}acetamide
2-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}acetamide
Compound characteristics
| Compound ID: | E645-0801 |
| Compound Name: | 2-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}acetamide |
| Molecular Weight: | 478.98 |
| Molecular Formula: | C26 H27 Cl N4 O3 |
| Smiles: | CCN(CCCNC(CN1C(c2cccnc2Oc2ccc(cc12)[Cl])=O)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.3607 |
| logD: | 4.3284 |
| logSw: | -4.5793 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.835 |
| InChI Key: | ONCSEYBCOJWZFX-UHFFFAOYSA-N |