(3S)-4-(benzenesulfonyl)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine
Chemical Structure Depiction of
(3S)-4-(benzenesulfonyl)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine
(3S)-4-(benzenesulfonyl)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine
Compound characteristics
| Compound ID: | S978-0205 |
| Compound Name: | (3S)-4-(benzenesulfonyl)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine |
| Molecular Weight: | 402.51 |
| Molecular Formula: | C21 H26 N2 O4 S |
| Smiles: | C[C@H]1COc2ccc(CN3CCOCC3)cc2CN1S(c1ccccc1)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.7063 |
| logD: | 2.6295 |
| logSw: | -3.0469 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.095 |
| InChI Key: | DXNHENHEQZGTAL-KRWDZBQOSA-N |