N-(2-cyanophenyl)-3-oxo-2-propyl-2,3-dihydro-1H-isoindole-4-carboxamide
Chemical Structure Depiction of
N-(2-cyanophenyl)-3-oxo-2-propyl-2,3-dihydro-1H-isoindole-4-carboxamide
N-(2-cyanophenyl)-3-oxo-2-propyl-2,3-dihydro-1H-isoindole-4-carboxamide
Compound characteristics
| Compound ID: | C612-0618 |
| Compound Name: | N-(2-cyanophenyl)-3-oxo-2-propyl-2,3-dihydro-1H-isoindole-4-carboxamide |
| Molecular Weight: | 319.36 |
| Molecular Formula: | C19 H17 N3 O2 |
| Smiles: | CCCN1Cc2cccc(C(Nc3ccccc3C#N)=O)c2C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.7767 |
| logD: | 2.7366 |
| logSw: | -3.3748 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.584 |
| InChI Key: | CANSMDLVGSDMGE-UHFFFAOYSA-N |