3-(4-methoxyphenyl)-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-(4-methoxyphenyl)-1-{7-[3-(morpholin-4-yl)-3-oxopropyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}propan-1-one
3-(4-methoxyphenyl)-1-{7-[3-(morpholin-4-yl)-3-oxopropyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}propan-1-one
Compound characteristics
| Compound ID: | S629-2623 |
| Compound Name: | 3-(4-methoxyphenyl)-1-{7-[3-(morpholin-4-yl)-3-oxopropyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}propan-1-one |
| Molecular Weight: | 452.55 |
| Molecular Formula: | C26 H32 N2 O5 |
| Smiles: | COc1ccc(CCC(N2CCOc3ccc(CCC(N4CCOCC4)=O)cc3C2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.826 |
| logD: | 2.826 |
| logSw: | -3.193 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.877 |
| InChI Key: | PGRBCMWLHPGRDM-UHFFFAOYSA-N |