N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[6-(thiomorpholin-4-yl)pyridin-3-yl]benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[6-(thiomorpholin-4-yl)pyridin-3-yl]benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[6-(thiomorpholin-4-yl)pyridin-3-yl]benzamide
Compound characteristics
| Compound ID: | M715-0626 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[6-(thiomorpholin-4-yl)pyridin-3-yl]benzamide |
| Molecular Weight: | 433.53 |
| Molecular Formula: | C24 H23 N3 O3 S |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1ccc(cc1)c1ccc(nc1)N1CCSCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4368 |
| logD: | 4.4015 |
| logSw: | -4.375 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.549 |
| InChI Key: | XCKNQNVZOLWXQH-UHFFFAOYSA-N |