(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)(3',5'-dimethyl-1'-propyl-1H,1'H-[3,4'-bipyrazol]-5-yl)methanone
Chemical Structure Depiction of
(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)(3',5'-dimethyl-1'-propyl-1H,1'H-[3,4'-bipyrazol]-5-yl)methanone
(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)(3',5'-dimethyl-1'-propyl-1H,1'H-[3,4'-bipyrazol]-5-yl)methanone
Compound characteristics
| Compound ID: | T501-1263 |
| Compound Name: | (3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)(3',5'-dimethyl-1'-propyl-1H,1'H-[3,4'-bipyrazol]-5-yl)methanone |
| Molecular Weight: | 450.59 |
| Molecular Formula: | C24 H34 N8 O |
| Smiles: | CCCn1c(C)c(c2cc(C(N3CCCC(Cc4nncn4CC4CC4)C3)=O)[nH]n2)c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.291 |
| logD: | 2.2907 |
| logSw: | -2.631 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.426 |
| InChI Key: | HITHBJFKTNCVEX-LJQANCHMSA-N |