1-[4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.5]decan-2-yl]-2-(4-methylphenyl)ethan-1-one
Chemical Structure Depiction of
1-[4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.5]decan-2-yl]-2-(4-methylphenyl)ethan-1-one
1-[4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.5]decan-2-yl]-2-(4-methylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | SC68-0133 |
| Compound Name: | 1-[4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.5]decan-2-yl]-2-(4-methylphenyl)ethan-1-one |
| Molecular Weight: | 366.51 |
| Molecular Formula: | C22 H30 N4 O |
| Smiles: | CCn1cnnc1C1CN(CC12CCCCC2)C(Cc1ccc(C)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9539 |
| logD: | 2.9534 |
| logSw: | -3.0217 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.594 |
| InChI Key: | JPWUVLYFJAIMEN-IBGZPJMESA-N |