3-(1H-indol-3-yl)-1-(4-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)propan-1-one
Chemical Structure Depiction of
3-(1H-indol-3-yl)-1-(4-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)propan-1-one
3-(1H-indol-3-yl)-1-(4-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | S564-0725 |
| Compound Name: | 3-(1H-indol-3-yl)-1-(4-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)propan-1-one |
| Molecular Weight: | 414.51 |
| Molecular Formula: | C24 H26 N6 O |
| Smiles: | C1CN(CCC1Cc1nnc(c2ccncc2)[nH]1)C(CCc1c[nH]c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.873 |
| logD: | 2.8497 |
| logSw: | -3.0748 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.162 |
| InChI Key: | UWDOHRSHYXMRJB-UHFFFAOYSA-N |