ethyl 3-[2-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamido]benzoate
Chemical Structure Depiction of
ethyl 3-[2-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamido]benzoate
ethyl 3-[2-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | E645-0686 |
| Compound Name: | ethyl 3-[2-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamido]benzoate |
| Molecular Weight: | 451.87 |
| Molecular Formula: | C23 H18 Cl N3 O5 |
| Smiles: | CCOC(c1cccc(c1)NC(CN1C(c2cccnc2Oc2ccc(cc12)[Cl])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.575 |
| logD: | 4.5749 |
| logSw: | -4.7089 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.435 |
| InChI Key: | SDZLFSKRFNPKDH-UHFFFAOYSA-N |