N-(2,5-dimethylphenyl)-N-ethyl-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
N-(2,5-dimethylphenyl)-N-ethyl-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
N-(2,5-dimethylphenyl)-N-ethyl-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
| Compound ID: | C909-0380 |
| Compound Name: | N-(2,5-dimethylphenyl)-N-ethyl-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
| Molecular Weight: | 411.54 |
| Molecular Formula: | C22 H21 N O3 S2 |
| Smiles: | CCN(C(c1cc2CS(c3ccccc3c2s1)(=O)=O)=O)c1cc(C)ccc1C |
| Stereo: | ACHIRAL |
| logP: | 5.2669 |
| logD: | 5.2669 |
| logSw: | -5.1129 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.478 |
| InChI Key: | MYFXTUMOGUUQTF-UHFFFAOYSA-N |