7-chloro-N-(2,5-difluorophenyl)-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
7-chloro-N-(2,5-difluorophenyl)-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
7-chloro-N-(2,5-difluorophenyl)-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
Compound ID: | C918-0188 |
Compound Name: | 7-chloro-N-(2,5-difluorophenyl)-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
Molecular Weight: | 425.86 |
Molecular Formula: | C18 H10 Cl F2 N O3 S2 |
Smiles: | C1c2cc(C(Nc3cc(ccc3F)F)=O)sc2c2ccc(cc2S1(=O)=O)[Cl] |
Stereo: | ACHIRAL |
logP: | 4.9026 |
logD: | 4.894 |
logSw: | -4.9933 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.825 |
InChI Key: | LSJULLFLIHMVBE-UHFFFAOYSA-N |