N-(3-acetamidophenyl)-2-cyclopropyl-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(3-acetamidophenyl)-2-cyclopropyl-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-(3-acetamidophenyl)-2-cyclopropyl-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y042-5299 |
| Compound Name: | N-(3-acetamidophenyl)-2-cyclopropyl-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 361.4 |
| Molecular Formula: | C21 H19 N3 O3 |
| Smiles: | CC(Nc1cccc(c1)NC(C1=CN(C2CC2)C(c2ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1013 |
| logD: | 2.1009 |
| logSw: | -3.0908 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.272 |
| InChI Key: | NEFANWKCQOFZOI-UHFFFAOYSA-N |