N-(5-methylpyridin-2-yl)-4H-[1]benzothiopyrano[3,4-d][1,2]oxazole-3-carboxamide
Chemical Structure Depiction of
N-(5-methylpyridin-2-yl)-4H-[1]benzothiopyrano[3,4-d][1,2]oxazole-3-carboxamide
N-(5-methylpyridin-2-yl)-4H-[1]benzothiopyrano[3,4-d][1,2]oxazole-3-carboxamide
Compound characteristics
| Compound ID: | E146-0961 |
| Compound Name: | N-(5-methylpyridin-2-yl)-4H-[1]benzothiopyrano[3,4-d][1,2]oxazole-3-carboxamide |
| Molecular Weight: | 323.37 |
| Molecular Formula: | C17 H13 N3 O2 S |
| Smiles: | Cc1ccc(NC(c2c3CSc4ccccc4c3on2)=O)nc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9667 |
| logD: | 3.9644 |
| logSw: | -4.0584 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.115 |
| InChI Key: | VVTONVIJZDAQBZ-UHFFFAOYSA-N |