2-(3-methylphenoxy)-1-{4-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-2-azaspiro[4.4]nonan-2-yl}ethan-1-one
Chemical Structure Depiction of
2-(3-methylphenoxy)-1-{4-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-2-azaspiro[4.4]nonan-2-yl}ethan-1-one
2-(3-methylphenoxy)-1-{4-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-2-azaspiro[4.4]nonan-2-yl}ethan-1-one
Compound characteristics
| Compound ID: | SC46-0541 |
| Compound Name: | 2-(3-methylphenoxy)-1-{4-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-2-azaspiro[4.4]nonan-2-yl}ethan-1-one |
| Molecular Weight: | 382.5 |
| Molecular Formula: | C22 H30 N4 O2 |
| Smiles: | CC(C)c1nc(C2CN(CC23CCCC3)C(COc2cccc(C)c2)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3524 |
| logD: | 3.3492 |
| logSw: | -3.5148 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.163 |
| InChI Key: | NWPLKHGTYROZMB-SFHVURJKSA-N |