1-[4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-2-(2-methylphenyl)ethan-1-one
Chemical Structure Depiction of
1-[4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-2-(2-methylphenyl)ethan-1-one
1-[4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-2-(2-methylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | SC69-0636 |
| Compound Name: | 1-[4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-2-(2-methylphenyl)ethan-1-one |
| Molecular Weight: | 352.48 |
| Molecular Formula: | C21 H28 N4 O |
| Smiles: | CCn1cnnc1C1CN(CC12CCCC2)C(Cc1ccccc1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7857 |
| logD: | 2.7852 |
| logSw: | -2.8277 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.96 |
| InChI Key: | HRKUJSXPTOIUOE-SFHVURJKSA-N |