1-{4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-(1H-indol-3-yl)ethan-1-one
Chemical Structure Depiction of
1-{4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-(1H-indol-3-yl)ethan-1-one
1-{4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-(1H-indol-3-yl)ethan-1-one
Compound characteristics
| Compound ID: | S564-0206 |
| Compound Name: | 1-{4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-(1H-indol-3-yl)ethan-1-one |
| Molecular Weight: | 351.45 |
| Molecular Formula: | C20 H25 N5 O |
| Smiles: | CCc1nnc(CC2CCN(CC2)C(Cc2c[nH]c3ccccc23)=O)[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 2.6585 |
| logD: | 2.6516 |
| logSw: | -2.7383 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.996 |
| InChI Key: | IMQWZCZLUWZKSI-UHFFFAOYSA-N |