methyl 4-[2-(2,4-difluoroanilino)-2-oxoethyl]-2-methyl-4H-thieno[3,2-b]pyrrole-5-carboxylate
Chemical Structure Depiction of
methyl 4-[2-(2,4-difluoroanilino)-2-oxoethyl]-2-methyl-4H-thieno[3,2-b]pyrrole-5-carboxylate
methyl 4-[2-(2,4-difluoroanilino)-2-oxoethyl]-2-methyl-4H-thieno[3,2-b]pyrrole-5-carboxylate
Compound characteristics
Compound ID: | C777-0798 |
Compound Name: | methyl 4-[2-(2,4-difluoroanilino)-2-oxoethyl]-2-methyl-4H-thieno[3,2-b]pyrrole-5-carboxylate |
Molecular Weight: | 364.37 |
Molecular Formula: | C17 H14 F2 N2 O3 S |
Smiles: | Cc1cc2c(cc(C(=O)OC)n2CC(Nc2ccc(cc2F)F)=O)s1 |
Stereo: | ACHIRAL |
logP: | 3.6621 |
logD: | 3.6424 |
logSw: | -3.9301 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 45.336 |
InChI Key: | RMYVYHDCJIDSTK-UHFFFAOYSA-N |