(3,5-dimethylphenyl)[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]methanone
Chemical Structure Depiction of
(3,5-dimethylphenyl)[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]methanone
(3,5-dimethylphenyl)[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]methanone
Compound characteristics
| Compound ID: | SC69-0022 |
| Compound Name: | (3,5-dimethylphenyl)[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]methanone |
| Molecular Weight: | 338.45 |
| Molecular Formula: | C20 H26 N4 O |
| Smiles: | Cc1cc(C)cc(c1)C(N1CC(c2nncn2C)C2(CCCC2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1889 |
| logD: | 2.1888 |
| logSw: | -2.09 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.318 |
| InChI Key: | YQPYEMKRADFYDC-KRWDZBQOSA-N |