N-[(furan-2-yl)methyl]-4-[(2S,4R)-4-hydroxy-2-{[(pyridin-3-yl)methyl]carbamoyl}pyrrolidin-1-yl]piperidine-1-carboxamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-4-[(2S,4R)-4-hydroxy-2-{[(pyridin-3-yl)methyl]carbamoyl}pyrrolidin-1-yl]piperidine-1-carboxamide
N-[(furan-2-yl)methyl]-4-[(2S,4R)-4-hydroxy-2-{[(pyridin-3-yl)methyl]carbamoyl}pyrrolidin-1-yl]piperidine-1-carboxamide
Compound characteristics
| Compound ID: | S596-2152 |
| Compound Name: | N-[(furan-2-yl)methyl]-4-[(2S,4R)-4-hydroxy-2-{[(pyridin-3-yl)methyl]carbamoyl}pyrrolidin-1-yl]piperidine-1-carboxamide |
| Molecular Weight: | 427.5 |
| Molecular Formula: | C22 H29 N5 O4 |
| Smiles: | C1CN(CCC1N1C[C@@H](C[C@H]1C(NCc1cccnc1)=O)O)C(NCc1ccco1)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.4859 |
| logD: | 0.426 |
| logSw: | -0.9362 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 87.519 |
| InChI Key: | WQKYJADEXACHCF-ICSRJNTNSA-N |