N-(3,5-dimethylphenyl)-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
N-(3,5-dimethylphenyl)-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
N-(3,5-dimethylphenyl)-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
| Compound ID: | C909-0540 |
| Compound Name: | N-(3,5-dimethylphenyl)-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
| Molecular Weight: | 383.49 |
| Molecular Formula: | C20 H17 N O3 S2 |
| Smiles: | Cc1cc(C)cc(c1)NC(c1cc2CS(c3ccccc3c2s1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5822 |
| logD: | 4.5822 |
| logSw: | -4.4566 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.523 |
| InChI Key: | CFWGEVVASFVUMN-UHFFFAOYSA-N |