1-{6-benzyl-8-[3-(propan-2-yl)-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-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-2,6-diazaspiro[3.4]octan-2-yl}-2-cyclopropylethan-1-one
1-{6-benzyl-8-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-2,6-diazaspiro[3.4]octan-2-yl}-2-cyclopropylethan-1-one
Compound characteristics
| Compound ID: | SC55-1573 |
| Compound Name: | 1-{6-benzyl-8-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-2,6-diazaspiro[3.4]octan-2-yl}-2-cyclopropylethan-1-one |
| Molecular Weight: | 393.53 |
| Molecular Formula: | C23 H31 N5 O |
| Smiles: | CC(C)c1nc(C2CN(Cc3ccccc3)CC23CN(C3)C(CC2CC2)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8782 |
| logD: | -1.4227 |
| logSw: | -3.1451 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.559 |
| InChI Key: | CUQZDJBIOOYUCL-LJQANCHMSA-N |