2-(3-methylbutyl)-1,3-dioxo-N-(pyridin-4-yl)-2,3-dihydro-1H-isoindole-5-carboxamide
Chemical Structure Depiction of
2-(3-methylbutyl)-1,3-dioxo-N-(pyridin-4-yl)-2,3-dihydro-1H-isoindole-5-carboxamide
2-(3-methylbutyl)-1,3-dioxo-N-(pyridin-4-yl)-2,3-dihydro-1H-isoindole-5-carboxamide
Compound characteristics
| Compound ID: | Y042-3592 |
| Compound Name: | 2-(3-methylbutyl)-1,3-dioxo-N-(pyridin-4-yl)-2,3-dihydro-1H-isoindole-5-carboxamide |
| Molecular Weight: | 337.38 |
| Molecular Formula: | C19 H19 N3 O3 |
| Smiles: | CC(C)CCN1C(c2ccc(cc2C1=O)C(Nc1ccncc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7659 |
| logD: | 2.7394 |
| logSw: | -3.2074 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.261 |
| InChI Key: | XMDDNCOFAPJUDJ-UHFFFAOYSA-N |