1-[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-2-(1H-tetrazol-1-yl)ethan-1-one
Chemical Structure Depiction of
1-[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-2-(1H-tetrazol-1-yl)ethan-1-one
1-[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-2-(1H-tetrazol-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | SC69-0089 |
| Compound Name: | 1-[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-2-(1H-tetrazol-1-yl)ethan-1-one |
| Molecular Weight: | 316.36 |
| Molecular Formula: | C14 H20 N8 O |
| Smiles: | Cn1cnnc1C1CN(CC12CCCC2)C(Cn1cnnn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.7371 |
| logD: | -0.7372 |
| logSw: | 0.1189 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 81.976 |
| InChI Key: | HTKDPAOOXRIPMT-NSHDSACASA-N |