(3S)-3-methyl-7-[(morpholin-4-yl)methyl]-4-(propane-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepine
Chemical Structure Depiction of
(3S)-3-methyl-7-[(morpholin-4-yl)methyl]-4-(propane-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepine
(3S)-3-methyl-7-[(morpholin-4-yl)methyl]-4-(propane-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepine
Compound characteristics
| Compound ID: | S978-0211 |
| Compound Name: | (3S)-3-methyl-7-[(morpholin-4-yl)methyl]-4-(propane-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepine |
| Molecular Weight: | 368.49 |
| Molecular Formula: | C18 H28 N2 O4 S |
| Smiles: | CCCS(N1Cc2cc(CN3CCOCC3)ccc2OC[C@@H]1C)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.921 |
| logD: | 1.8442 |
| logSw: | -2.5971 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.26 |
| InChI Key: | SHQDCOZYLNSNBO-HNNXBMFYSA-N |