1-[(3S)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]-2-(thiophen-2-yl)ethan-1-one
Chemical Structure Depiction of
1-[(3S)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]-2-(thiophen-2-yl)ethan-1-one
1-[(3S)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]-2-(thiophen-2-yl)ethan-1-one
Compound characteristics
| Compound ID: | S978-0224 |
| Compound Name: | 1-[(3S)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]-2-(thiophen-2-yl)ethan-1-one |
| Molecular Weight: | 386.51 |
| Molecular Formula: | C21 H26 N2 O3 S |
| Smiles: | C[C@H]1COc2ccc(CN3CCOCC3)cc2CN1C(Cc1cccs1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.5566 |
| logD: | 2.4946 |
| logSw: | -2.7758 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.746 |
| InChI Key: | FMVCXIDWCOKRTA-INIZCTEOSA-N |