1-[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-3-phenylpropan-1-one
Chemical Structure Depiction of
1-[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-3-phenylpropan-1-one
1-[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-3-phenylpropan-1-one
Compound characteristics
| Compound ID: | SC69-0098 |
| Compound Name: | 1-[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-3-phenylpropan-1-one |
| Molecular Weight: | 338.45 |
| Molecular Formula: | C20 H26 N4 O |
| Smiles: | Cn1cnnc1C1CN(CC12CCCC2)C(CCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0239 |
| logD: | 2.0237 |
| logSw: | -2.1081 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.791 |
| InChI Key: | VYOJYDYVELJDFN-KRWDZBQOSA-N |