3-(1H-indol-3-yl)-1-{7-[3-(morpholin-4-yl)-3-oxopropyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}propan-1-one
Chemical Structure Depiction of
3-(1H-indol-3-yl)-1-{7-[3-(morpholin-4-yl)-3-oxopropyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}propan-1-one
3-(1H-indol-3-yl)-1-{7-[3-(morpholin-4-yl)-3-oxopropyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}propan-1-one
Compound characteristics
| Compound ID: | S629-2620 |
| Compound Name: | 3-(1H-indol-3-yl)-1-{7-[3-(morpholin-4-yl)-3-oxopropyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}propan-1-one |
| Molecular Weight: | 461.56 |
| Molecular Formula: | C27 H31 N3 O4 |
| Smiles: | C(Cc1ccc2c(CN(CCO2)C(CCc2c[nH]c3ccccc23)=O)c1)C(N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8971 |
| logD: | 2.8971 |
| logSw: | -3.2216 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.204 |
| InChI Key: | WJVAMSURNNUDBY-UHFFFAOYSA-N |