7-chloro-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
7-chloro-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
7-chloro-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
| Compound ID: | C918-0461 |
| Compound Name: | 7-chloro-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
| Molecular Weight: | 439.94 |
| Molecular Formula: | C22 H14 Cl N O3 S2 |
| Smiles: | CC1=CC(=O)Oc2cc(ccc12)NC(c1cc2CSc3cc(ccc3c2s1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5447 |
| logD: | 5.5445 |
| logSw: | -5.8512 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.404 |
| InChI Key: | PHKUBKDNPAXYDI-UHFFFAOYSA-N |