[(3S)-4-(ethanesulfonyl)-3-methyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl](pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
[(3S)-4-(ethanesulfonyl)-3-methyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl](pyrrolidin-1-yl)methanone
[(3S)-4-(ethanesulfonyl)-3-methyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl](pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | S979-0317 |
| Compound Name: | [(3S)-4-(ethanesulfonyl)-3-methyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl](pyrrolidin-1-yl)methanone |
| Molecular Weight: | 352.45 |
| Molecular Formula: | C17 H24 N2 O4 S |
| Smiles: | CCS(N1Cc2cc(ccc2OC[C@@H]1C)C(N1CCCC1)=O)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.8386 |
| logD: | 1.8386 |
| logSw: | -2.588 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.634 |
| InChI Key: | SKNFIRMQHMGLTJ-ZDUSSCGKSA-N |