N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(3-cyanoquinolin-4-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(3-cyanoquinolin-4-yl)piperidine-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(3-cyanoquinolin-4-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | L483-0016 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(3-cyanoquinolin-4-yl)piperidine-4-carboxamide |
| Molecular Weight: | 414.46 |
| Molecular Formula: | C24 H22 N4 O3 |
| Smiles: | C1CN(CCC1C(NCc1ccc2c(c1)OCO2)=O)c1c(C#N)cnc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 2.8949 |
| logD: | 2.8943 |
| logSw: | -3.2093 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.526 |
| InChI Key: | JRPAOEXSYQWOFZ-UHFFFAOYSA-N |