N-(3-acetylphenyl)-7-chloro-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-7-chloro-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
N-(3-acetylphenyl)-7-chloro-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
| Compound ID: | C918-0182 |
| Compound Name: | N-(3-acetylphenyl)-7-chloro-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
| Molecular Weight: | 431.91 |
| Molecular Formula: | C20 H14 Cl N O4 S2 |
| Smiles: | CC(c1cccc(c1)NC(c1cc2CS(c3cc(ccc3c2s1)[Cl])(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.278 |
| logD: | 4.2779 |
| logSw: | -4.5966 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.349 |
| InChI Key: | LOPJJLZHZUMJJF-UHFFFAOYSA-N |