2-cyclohexyl-N-[(2,4-dimethoxyphenyl)methyl]-3-oxo-2,3-dihydro-1H-pyrrolo[3,4-b]quinoline-9-carboxamide
Chemical Structure Depiction of
2-cyclohexyl-N-[(2,4-dimethoxyphenyl)methyl]-3-oxo-2,3-dihydro-1H-pyrrolo[3,4-b]quinoline-9-carboxamide
2-cyclohexyl-N-[(2,4-dimethoxyphenyl)methyl]-3-oxo-2,3-dihydro-1H-pyrrolo[3,4-b]quinoline-9-carboxamide
Compound characteristics
| Compound ID: | C066-4858 |
| Compound Name: | 2-cyclohexyl-N-[(2,4-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(CNC(c2c3CN(C4CCCCC4)C(c3nc3ccccc23)=O)=O)c(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.5761 |
| logD: | 4.5761 |
| logSw: | -4.5918 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.051 |
| InChI Key: | IPESRDPCLWOYLI-UHFFFAOYSA-N |