N-[1-(isoquinoline-1-carbonyl)piperidin-4-yl]-N-(oxan-4-yl)-N'-propylurea
Chemical Structure Depiction of
N-[1-(isoquinoline-1-carbonyl)piperidin-4-yl]-N-(oxan-4-yl)-N'-propylurea
N-[1-(isoquinoline-1-carbonyl)piperidin-4-yl]-N-(oxan-4-yl)-N'-propylurea
Compound characteristics
| Compound ID: | S329-2172 |
| Compound Name: | N-[1-(isoquinoline-1-carbonyl)piperidin-4-yl]-N-(oxan-4-yl)-N'-propylurea |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C24 H32 N4 O3 |
| Smiles: | CCCNC(N(C1CCN(CC1)C(c1c2ccccc2ccn1)=O)C1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0812 |
| logD: | 3.0806 |
| logSw: | -3.0739 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.943 |
| InChI Key: | YLXYHXCYXLPGLF-UHFFFAOYSA-N |