{4-[(5-cyclopropyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(quinolin-2-yl)methanone
Chemical Structure Depiction of
{4-[(5-cyclopropyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(quinolin-2-yl)methanone
{4-[(5-cyclopropyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(quinolin-2-yl)methanone
Compound characteristics
| Compound ID: | S564-0557 |
| Compound Name: | {4-[(5-cyclopropyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(quinolin-2-yl)methanone |
| Molecular Weight: | 361.45 |
| Molecular Formula: | C21 H23 N5 O |
| Smiles: | C1CN(CCC1Cc1nnc(C2CC2)[nH]1)C(c1ccc2ccccc2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0896 |
| logD: | 3.0861 |
| logSw: | -3.4807 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.244 |
| InChI Key: | DLCFMTIIYSSXFM-UHFFFAOYSA-N |