2-(3-methylbutyl)-1-oxo-N-(pyridin-2-yl)-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(3-methylbutyl)-1-oxo-N-(pyridin-2-yl)-1,2-dihydroisoquinoline-4-carboxamide
2-(3-methylbutyl)-1-oxo-N-(pyridin-2-yl)-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y042-5501 |
| Compound Name: | 2-(3-methylbutyl)-1-oxo-N-(pyridin-2-yl)-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 335.4 |
| Molecular Formula: | C20 H21 N3 O2 |
| Smiles: | CC(C)CCN1C=C(C(Nc2ccccn2)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.396 |
| logD: | 3.2794 |
| logSw: | -3.7919 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.156 |
| InChI Key: | DMYSENVCIQLWHH-UHFFFAOYSA-N |