N-(oxan-4-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]isoquinoline-1-carboxamide
Chemical Structure Depiction of
N-(oxan-4-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]isoquinoline-1-carboxamide
N-(oxan-4-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]isoquinoline-1-carboxamide
Compound characteristics
| Compound ID: | SC12-0551 |
| Compound Name: | N-(oxan-4-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]isoquinoline-1-carboxamide |
| Molecular Weight: | 381.47 |
| Molecular Formula: | C22 H27 N3 O3 |
| Smiles: | C1CC(N(C1)CCCN(C1CCOCC1)C(c1c2ccccc2ccn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3399 |
| logD: | 1.3399 |
| logSw: | -2.0794 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.368 |
| InChI Key: | DUORTTQAQBUSAU-UHFFFAOYSA-N |