1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-3-(3-methoxyphenyl)propan-1-one
Chemical Structure Depiction of
1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-3-(3-methoxyphenyl)propan-1-one
1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-3-(3-methoxyphenyl)propan-1-one
Compound characteristics
| Compound ID: | T501-0630 |
| Compound Name: | 1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-3-(3-methoxyphenyl)propan-1-one |
| Molecular Weight: | 382.5 |
| Molecular Formula: | C22 H30 N4 O2 |
| Smiles: | COc1cccc(CCC(N2CCCC(Cc3nncn3CC3CC3)C2)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.856 |
| logD: | 2.856 |
| logSw: | -3.2048 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.421 |
| InChI Key: | HQYIVROVLBCCIJ-LJQANCHMSA-N |