(3-methylphenyl)(3-{[5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]methyl}pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
(3-methylphenyl)(3-{[5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]methyl}pyrrolidin-1-yl)methanone
(3-methylphenyl)(3-{[5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]methyl}pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | P937-1930 |
| Compound Name: | (3-methylphenyl)(3-{[5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]methyl}pyrrolidin-1-yl)methanone |
| Molecular Weight: | 347.42 |
| Molecular Formula: | C20 H21 N5 O |
| Smiles: | Cc1cccc(c1)C(N1CCC(Cc2nnc(c3cccnc3)[nH]2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.037 |
| logD: | 1.9324 |
| logSw: | -2.1552 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.208 |
| InChI Key: | JHDLOYLHEYAONT-HNNXBMFYSA-N |