2-cyclohexyl-N-[(2,5-dimethoxyphenyl)methyl]-3-oxo-2,3-dihydro-1H-pyrrolo[3,4-b]quinoline-9-carboxamide
Chemical Structure Depiction of
2-cyclohexyl-N-[(2,5-dimethoxyphenyl)methyl]-3-oxo-2,3-dihydro-1H-pyrrolo[3,4-b]quinoline-9-carboxamide
2-cyclohexyl-N-[(2,5-dimethoxyphenyl)methyl]-3-oxo-2,3-dihydro-1H-pyrrolo[3,4-b]quinoline-9-carboxamide
Compound characteristics
Compound ID: | G211-0184 |
Compound Name: | 2-cyclohexyl-N-[(2,5-dimethoxyphenyl)methyl]-3-oxo-2,3-dihydro-1H-pyrrolo[3,4-b]quinoline-9-carboxamide |
Molecular Weight: | 459.54 |
Molecular Formula: | C27 H29 N3 O4 |
Smiles: | COc1ccc(c(CNC(c2c3CN(C4CCCCC4)C(c3nc3ccccc23)=O)=O)c1)OC |
Stereo: | ACHIRAL |
logP: | 4.5566 |
logD: | 4.5566 |
logSw: | -4.5998 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.051 |
InChI Key: | GIYQQGDPACIAJQ-UHFFFAOYSA-N |