ethyl 4-acetamido-6-[(4-bromo-2-fluorophenyl)methyl]-2,3-dimethyl-6H-thieno[2,3-b]pyrrole-5-carboxylate
Chemical Structure Depiction of
ethyl 4-acetamido-6-[(4-bromo-2-fluorophenyl)methyl]-2,3-dimethyl-6H-thieno[2,3-b]pyrrole-5-carboxylate
ethyl 4-acetamido-6-[(4-bromo-2-fluorophenyl)methyl]-2,3-dimethyl-6H-thieno[2,3-b]pyrrole-5-carboxylate
Compound characteristics
Compound ID: | E649-1669 |
Compound Name: | ethyl 4-acetamido-6-[(4-bromo-2-fluorophenyl)methyl]-2,3-dimethyl-6H-thieno[2,3-b]pyrrole-5-carboxylate |
Molecular Weight: | 467.36 |
Molecular Formula: | C20 H20 Br F N2 O3 S |
Smiles: | CCOC(c1c(c2c(C)c(C)sc2n1Cc1ccc(cc1F)[Br])NC(C)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.4505 |
logD: | 3.8661 |
logSw: | -4.5005 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 43.942 |
InChI Key: | BXULMTBAPHBLRT-UHFFFAOYSA-N |