{(2S,4R)-4-hydroxy-1-[1-(3-methoxybenzoyl)piperidin-4-yl]pyrrolidin-2-yl}[4-(prop-2-en-1-yl)piperazin-1-yl]methanone
Chemical Structure Depiction of
{(2S,4R)-4-hydroxy-1-[1-(3-methoxybenzoyl)piperidin-4-yl]pyrrolidin-2-yl}[4-(prop-2-en-1-yl)piperazin-1-yl]methanone
{(2S,4R)-4-hydroxy-1-[1-(3-methoxybenzoyl)piperidin-4-yl]pyrrolidin-2-yl}[4-(prop-2-en-1-yl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | S596-0892 |
| Compound Name: | {(2S,4R)-4-hydroxy-1-[1-(3-methoxybenzoyl)piperidin-4-yl]pyrrolidin-2-yl}[4-(prop-2-en-1-yl)piperazin-1-yl]methanone |
| Molecular Weight: | 456.59 |
| Molecular Formula: | C25 H36 N4 O4 |
| Smiles: | COc1cccc(c1)C(N1CCC(CC1)N1C[C@@H](C[C@H]1C(N1CCN(CC1)CC=C)=O)O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.11 |
| logD: | 1.034 |
| logSw: | -1.9869 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.678 |
| InChI Key: | YXVWOPYIBRKYLB-GMAHTHKFSA-N |