(3,4-dimethylphenyl)[8-(5-methyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]methanone
Chemical Structure Depiction of
(3,4-dimethylphenyl)[8-(5-methyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]methanone
(3,4-dimethylphenyl)[8-(5-methyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]methanone
Compound characteristics
| Compound ID: | SC70-0558 |
| Compound Name: | (3,4-dimethylphenyl)[8-(5-methyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]methanone |
| Molecular Weight: | 324.42 |
| Molecular Formula: | C19 H24 N4 O |
| Smiles: | Cc1ccc(cc1C)C(N1CC(c2nc(C)[nH]n2)C2(CCC2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8028 |
| logD: | 2.8008 |
| logSw: | -3.199 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.769 |
| InChI Key: | HQQGEBQZGKSLRZ-INIZCTEOSA-N |