2-cyclohexyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrolo[3,4-b]quinoline-9-carboxamide
Chemical Structure Depiction of
2-cyclohexyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrolo[3,4-b]quinoline-9-carboxamide
2-cyclohexyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrolo[3,4-b]quinoline-9-carboxamide
Compound characteristics
Compound ID: | G211-0198 |
Compound Name: | 2-cyclohexyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrolo[3,4-b]quinoline-9-carboxamide |
Molecular Weight: | 486.59 |
Molecular Formula: | C27 H26 N4 O3 S |
Smiles: | CCOc1ccc2c(c1)sc(NC(c1c3CN(C4CCCCC4)C(c3nc3ccccc13)=O)=O)n2 |
Stereo: | ACHIRAL |
logP: | 6.1309 |
logD: | 6.1282 |
logSw: | -5.6719 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.44 |
InChI Key: | OKBPCWUTNAHJNM-UHFFFAOYSA-N |