1-[6-benzyl-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-2-yl]-2-(2-methylphenyl)ethan-1-one
Chemical Structure Depiction of
1-[6-benzyl-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-2-yl]-2-(2-methylphenyl)ethan-1-one
1-[6-benzyl-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-2-yl]-2-(2-methylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | SB59-0619 |
| Compound Name: | 1-[6-benzyl-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-2-yl]-2-(2-methylphenyl)ethan-1-one |
| Molecular Weight: | 415.54 |
| Molecular Formula: | C25 H29 N5 O |
| Smiles: | Cc1ccccc1CC(N1CC2(CN(CC2c2nncn2C)Cc2ccccc2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.761 |
| logD: | -0.6471 |
| logSw: | -2.7016 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.163 |
| InChI Key: | LIOXMLUPOBPBJW-JOCHJYFZSA-N |