2-(3-methylphenoxy)-1-[8-(5-propyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]ethan-1-one
Chemical Structure Depiction of
2-(3-methylphenoxy)-1-[8-(5-propyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]ethan-1-one
2-(3-methylphenoxy)-1-[8-(5-propyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]ethan-1-one
Compound characteristics
| Compound ID: | SC70-0452 |
| Compound Name: | 2-(3-methylphenoxy)-1-[8-(5-propyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]ethan-1-one |
| Molecular Weight: | 368.48 |
| Molecular Formula: | C21 H28 N4 O2 |
| Smiles: | CCCc1nc(C2CN(CC23CCC3)C(COc2cccc(C)c2)=O)n[nH]1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2869 |
| logD: | 3.2843 |
| logSw: | -3.3722 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.118 |
| InChI Key: | YCJCDSROSPXEOI-KRWDZBQOSA-N |