1-{4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-2-azaspiro[4.5]decan-2-yl}-2-(pyridin-4-yl)ethan-1-one
Chemical Structure Depiction of
1-{4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-2-azaspiro[4.5]decan-2-yl}-2-(pyridin-4-yl)ethan-1-one
1-{4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-2-azaspiro[4.5]decan-2-yl}-2-(pyridin-4-yl)ethan-1-one
Compound characteristics
| Compound ID: | SC68-2004 |
| Compound Name: | 1-{4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-2-azaspiro[4.5]decan-2-yl}-2-(pyridin-4-yl)ethan-1-one |
| Molecular Weight: | 381.52 |
| Molecular Formula: | C22 H31 N5 O |
| Smiles: | CC(C)Cn1cnnc1C1CN(CC12CCCCC2)C(Cc1ccncc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1392 |
| logD: | 2.1265 |
| logSw: | -2.1545 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.297 |
| InChI Key: | LGFSIRWATMGUEG-IBGZPJMESA-N |