7-chloro-N-(2-fluorophenyl)-N-methyl-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
7-chloro-N-(2-fluorophenyl)-N-methyl-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
7-chloro-N-(2-fluorophenyl)-N-methyl-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
Compound ID: | C918-0104 |
Compound Name: | 7-chloro-N-(2-fluorophenyl)-N-methyl-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
Molecular Weight: | 421.89 |
Molecular Formula: | C19 H13 Cl F N O3 S2 |
Smiles: | CN(C(c1cc2CS(c3cc(ccc3c2s1)[Cl])(=O)=O)=O)c1ccccc1F |
Stereo: | ACHIRAL |
logP: | 4.3564 |
logD: | 4.3564 |
logSw: | -4.5801 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 44.5 |
InChI Key: | BCJIKAOEBOSBGM-UHFFFAOYSA-N |