methyl 3-{[1-(3-cyano-6-methoxyquinolin-4-yl)piperidine-4-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 3-{[1-(3-cyano-6-methoxyquinolin-4-yl)piperidine-4-carbonyl]amino}benzoate
methyl 3-{[1-(3-cyano-6-methoxyquinolin-4-yl)piperidine-4-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | L483-0188 |
| Compound Name: | methyl 3-{[1-(3-cyano-6-methoxyquinolin-4-yl)piperidine-4-carbonyl]amino}benzoate |
| Molecular Weight: | 444.49 |
| Molecular Formula: | C25 H24 N4 O4 |
| Smiles: | COC(c1cccc(c1)NC(C1CCN(CC1)c1c(C#N)cnc2ccc(cc12)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.782 |
| logD: | 3.7533 |
| logSw: | -3.928 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.807 |
| InChI Key: | GEARKECJOXCOPC-UHFFFAOYSA-N |