[(3S)-3-methyl-7-(pyrrolidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](thiophen-3-yl)methanone
Chemical Structure Depiction of
[(3S)-3-methyl-7-(pyrrolidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](thiophen-3-yl)methanone
[(3S)-3-methyl-7-(pyrrolidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](thiophen-3-yl)methanone
Compound characteristics
| Compound ID: | S979-0340 |
| Compound Name: | [(3S)-3-methyl-7-(pyrrolidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](thiophen-3-yl)methanone |
| Molecular Weight: | 370.47 |
| Molecular Formula: | C20 H22 N2 O3 S |
| Smiles: | C[C@H]1COc2ccc(cc2CN1C(c1ccsc1)=O)C(N1CCCC1)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.0012 |
| logD: | 3.0012 |
| logSw: | -3.2225 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.647 |
| InChI Key: | WTKNAZOQTNGPBE-AWEZNQCLSA-N |