(2H-1,3-benzodioxol-5-yl)[3-(5-methyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone
Chemical Structure Depiction of
(2H-1,3-benzodioxol-5-yl)[3-(5-methyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone
(2H-1,3-benzodioxol-5-yl)[3-(5-methyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone
Compound characteristics
| Compound ID: | T629-1774 |
| Compound Name: | (2H-1,3-benzodioxol-5-yl)[3-(5-methyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone |
| Molecular Weight: | 314.34 |
| Molecular Formula: | C16 H18 N4 O3 |
| Smiles: | Cc1nnc(C2CCCN(C2)C(c2ccc3c(c2)OCO3)=O)[nH]1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9452 |
| logD: | 0.9422 |
| logSw: | -1.9305 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.333 |
| InChI Key: | GPEATHARHGOYNB-LBPRGKRZSA-N |