1-[4-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]-2-(4-methylphenyl)ethan-1-one
Chemical Structure Depiction of
1-[4-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]-2-(4-methylphenyl)ethan-1-one
1-[4-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]-2-(4-methylphenyl)ethan-1-one
Compound characteristics
Compound ID: | SC46-0200 |
Compound Name: | 1-[4-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]-2-(4-methylphenyl)ethan-1-one |
Molecular Weight: | 364.49 |
Molecular Formula: | C22 H28 N4 O |
Smiles: | Cc1ccc(CC(N2CC(c3nc(C4CC4)n[nH]3)C3(CCCC3)C2)=O)cc1 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.6317 |
logD: | 3.5792 |
logSw: | -3.6874 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.915 |
InChI Key: | GIBSAOHIHCJOEY-SFHVURJKSA-N |