2-(2,5-dimethylphenoxy)-1-[8-(4-methyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]ethan-1-one
Chemical Structure Depiction of
2-(2,5-dimethylphenoxy)-1-[8-(4-methyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]ethan-1-one
2-(2,5-dimethylphenoxy)-1-[8-(4-methyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]ethan-1-one
Compound characteristics
| Compound ID: | SD74-0067 |
| Compound Name: | 2-(2,5-dimethylphenoxy)-1-[8-(4-methyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]ethan-1-one |
| Molecular Weight: | 354.45 |
| Molecular Formula: | C20 H26 N4 O2 |
| Smiles: | Cc1ccc(C)c(c1)OCC(N1CC(c2nncn2C)C2(CCC2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.798 |
| logD: | 1.7979 |
| logSw: | -2.2094 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.342 |
| InChI Key: | LNBSDFJYTPSKGS-INIZCTEOSA-N |