7-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
7-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
7-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
| Compound ID: | C918-0249 |
| Compound Name: | 7-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
| Molecular Weight: | 415.92 |
| Molecular Formula: | C20 H14 Cl N O3 S2 |
| Smiles: | C1COc2cc(ccc2O1)NC(c1cc2CSc3cc(ccc3c2s1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.555 |
| logD: | 4.5549 |
| logSw: | -4.7049 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.82 |
| InChI Key: | VYKXXXDBGKKHSP-UHFFFAOYSA-N |