1-[6-benzyl-8-(3-methyl-1H-1,2,4-triazol-5-yl)-2,6-diazaspiro[3.4]octan-2-yl]-2-cyclopropylethan-1-one
Chemical Structure Depiction of
1-[6-benzyl-8-(3-methyl-1H-1,2,4-triazol-5-yl)-2,6-diazaspiro[3.4]octan-2-yl]-2-cyclopropylethan-1-one
1-[6-benzyl-8-(3-methyl-1H-1,2,4-triazol-5-yl)-2,6-diazaspiro[3.4]octan-2-yl]-2-cyclopropylethan-1-one
Compound characteristics
| Compound ID: | SC55-0596 |
| Compound Name: | 1-[6-benzyl-8-(3-methyl-1H-1,2,4-triazol-5-yl)-2,6-diazaspiro[3.4]octan-2-yl]-2-cyclopropylethan-1-one |
| Molecular Weight: | 365.48 |
| Molecular Formula: | C21 H27 N5 O |
| Smiles: | Cc1nc(C2CN(Cc3ccccc3)CC23CN(C3)C(CC2CC2)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7562 |
| logD: | -2.5448 |
| logSw: | -2.086 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.172 |
| InChI Key: | HJBSDGXPUQBUFK-GOSISDBHSA-N |