1-[2-benzyl-4-(4-methyl-4H-1,2,4-triazol-3-yl)-2,8-diazaspiro[4.5]decan-8-yl]-2-(2-methylphenyl)ethan-1-one
Chemical Structure Depiction of
1-[2-benzyl-4-(4-methyl-4H-1,2,4-triazol-3-yl)-2,8-diazaspiro[4.5]decan-8-yl]-2-(2-methylphenyl)ethan-1-one
1-[2-benzyl-4-(4-methyl-4H-1,2,4-triazol-3-yl)-2,8-diazaspiro[4.5]decan-8-yl]-2-(2-methylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | SC67-1060 |
| Compound Name: | 1-[2-benzyl-4-(4-methyl-4H-1,2,4-triazol-3-yl)-2,8-diazaspiro[4.5]decan-8-yl]-2-(2-methylphenyl)ethan-1-one |
| Molecular Weight: | 443.59 |
| Molecular Formula: | C27 H33 N5 O |
| Smiles: | Cc1ccccc1CC(N1CCC2(CC1)CN(CC2c1nncn1C)Cc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9935 |
| logD: | 1.05 |
| logSw: | -3.0373 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.965 |
| InChI Key: | BIGWJPWCESOXSO-XMMPIXPASA-N |