3-(3,5-dimethyl-1H-pyrazol-1-yl)-1-{4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}propan-1-one
Chemical Structure Depiction of
3-(3,5-dimethyl-1H-pyrazol-1-yl)-1-{4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}propan-1-one
3-(3,5-dimethyl-1H-pyrazol-1-yl)-1-{4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}propan-1-one
Compound characteristics
| Compound ID: | S564-0265 |
| Compound Name: | 3-(3,5-dimethyl-1H-pyrazol-1-yl)-1-{4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}propan-1-one |
| Molecular Weight: | 344.46 |
| Molecular Formula: | C18 H28 N6 O |
| Smiles: | CCc1nnc(CC2CCN(CC2)C(CCn2c(C)cc(C)n2)=O)[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 0.8165 |
| logD: | 0.8097 |
| logSw: | -1.5343 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.111 |
| InChI Key: | TXCJVYBTQSXGGU-UHFFFAOYSA-N |