7-(3-{[2-(morpholin-4-yl)ethyl]amino}-3-oxopropyl)-N-(propan-2-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Chemical Structure Depiction of
7-(3-{[2-(morpholin-4-yl)ethyl]amino}-3-oxopropyl)-N-(propan-2-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
7-(3-{[2-(morpholin-4-yl)ethyl]amino}-3-oxopropyl)-N-(propan-2-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Compound characteristics
| Compound ID: | S629-0579 |
| Compound Name: | 7-(3-{[2-(morpholin-4-yl)ethyl]amino}-3-oxopropyl)-N-(propan-2-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide |
| Molecular Weight: | 418.54 |
| Molecular Formula: | C22 H34 N4 O4 |
| Smiles: | CC(C)NC(N1CCOc2ccc(CCC(NCCN3CCOCC3)=O)cc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.247 |
| logD: | 1.1712 |
| logSw: | -2.3027 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.152 |
| InChI Key: | GIMIFKYWWYEQGT-UHFFFAOYSA-N |