(4S)-1-[1-(isoquinoline-1-carbonyl)piperidin-4-yl]-N-methyl-4-phenoxy-L-prolinamide
Chemical Structure Depiction of
(4S)-1-[1-(isoquinoline-1-carbonyl)piperidin-4-yl]-N-methyl-4-phenoxy-L-prolinamide
(4S)-1-[1-(isoquinoline-1-carbonyl)piperidin-4-yl]-N-methyl-4-phenoxy-L-prolinamide
Compound characteristics
| Compound ID: | S720-2358 |
| Compound Name: | (4S)-1-[1-(isoquinoline-1-carbonyl)piperidin-4-yl]-N-methyl-4-phenoxy-L-prolinamide |
| Molecular Weight: | 458.56 |
| Molecular Formula: | C27 H30 N4 O3 |
| Smiles: | CNC([C@@H]1C[C@@H](CN1C1CCN(CC1)C(c1c2ccccc2ccn1)=O)Oc1ccccc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.8154 |
| logD: | 2.7972 |
| logSw: | -2.9934 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.617 |
| InChI Key: | XTHHTKJZTKUYKY-VWNXMTODSA-N |