{7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(thiophen-2-yl)methanone
Chemical Structure Depiction of
{7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(thiophen-2-yl)methanone
{7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(thiophen-2-yl)methanone
Compound characteristics
| Compound ID: | T634-0641 |
| Compound Name: | {7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(thiophen-2-yl)methanone |
| Molecular Weight: | 356.49 |
| Molecular Formula: | C20 H24 N2 O2 S |
| Smiles: | C1CCN(CC1)Cc1ccc2c(CN(CCO2)C(c2cccs2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.467 |
| logD: | 1.836 |
| logSw: | -3.5143 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.5818 |
| InChI Key: | KYHDNBGAHDGGBH-UHFFFAOYSA-N |