(3-methylthiophen-2-yl){7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}methanone
Chemical Structure Depiction of
(3-methylthiophen-2-yl){7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}methanone
(3-methylthiophen-2-yl){7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}methanone
Compound characteristics
| Compound ID: | T634-0650 |
| Compound Name: | (3-methylthiophen-2-yl){7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}methanone |
| Molecular Weight: | 370.51 |
| Molecular Formula: | C21 H26 N2 O2 S |
| Smiles: | Cc1ccsc1C(N1CCOc2ccc(CN3CCCCC3)cc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8329 |
| logD: | 2.2018 |
| logSw: | -3.7249 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.5818 |
| InChI Key: | JKAGAWVGLPOQRG-UHFFFAOYSA-N |