(3-methylphenyl)[8-(5-methyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]methanone
Chemical Structure Depiction of
(3-methylphenyl)[8-(5-methyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]methanone
(3-methylphenyl)[8-(5-methyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]methanone
Compound characteristics
| Compound ID: | SC70-0563 |
| Compound Name: | (3-methylphenyl)[8-(5-methyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]methanone |
| Molecular Weight: | 310.4 |
| Molecular Formula: | C18 H22 N4 O |
| Smiles: | Cc1cccc(c1)C(N1CC(c2nc(C)[nH]n2)C2(CCC2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.188 |
| logD: | 2.1859 |
| logSw: | -2.741 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.769 |
| InChI Key: | JXTBKZUXLLDSDH-HNNXBMFYSA-N |