N-(2-cyanoethyl)-8-methyl-4-oxo-N-phenyl-4,5-dihydrothieno[3,2-c]quinoline-2-carboxamide
Chemical Structure Depiction of
N-(2-cyanoethyl)-8-methyl-4-oxo-N-phenyl-4,5-dihydrothieno[3,2-c]quinoline-2-carboxamide
N-(2-cyanoethyl)-8-methyl-4-oxo-N-phenyl-4,5-dihydrothieno[3,2-c]quinoline-2-carboxamide
Compound characteristics
Compound ID: | C734-0235 |
Compound Name: | N-(2-cyanoethyl)-8-methyl-4-oxo-N-phenyl-4,5-dihydrothieno[3,2-c]quinoline-2-carboxamide |
Molecular Weight: | 387.46 |
Molecular Formula: | C22 H17 N3 O2 S |
Smiles: | Cc1ccc2c(c1)c1c(cc(C(N(CCC#N)c3ccccc3)=O)s1)C(N2)=O |
Stereo: | ACHIRAL |
logP: | 3.9811 |
logD: | 3.9811 |
logSw: | -4.0606 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.956 |
InChI Key: | JEKFZNMLFAXLSJ-UHFFFAOYSA-N |