2-(2-methylphenyl)-1-{4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-2-azaspiro[4.5]decan-2-yl}ethan-1-one
Chemical Structure Depiction of
2-(2-methylphenyl)-1-{4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-2-azaspiro[4.5]decan-2-yl}ethan-1-one
2-(2-methylphenyl)-1-{4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-2-azaspiro[4.5]decan-2-yl}ethan-1-one
Compound characteristics
| Compound ID: | SC68-2030 |
| Compound Name: | 2-(2-methylphenyl)-1-{4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-2-azaspiro[4.5]decan-2-yl}ethan-1-one |
| Molecular Weight: | 394.56 |
| Molecular Formula: | C24 H34 N4 O |
| Smiles: | CC(C)Cn1cnnc1C1CN(CC12CCCCC2)C(Cc1ccccc1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2526 |
| logD: | 4.2525 |
| logSw: | -4.182 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.869 |
| InChI Key: | UIPHOEVORRNBPC-NRFANRHFSA-N |