2-(4-fluorophenyl)-1-{4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decan-2-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-fluorophenyl)-1-{4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decan-2-yl}ethan-1-one
2-(4-fluorophenyl)-1-{4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decan-2-yl}ethan-1-one
Compound characteristics
| Compound ID: | SC66-0220 |
| Compound Name: | 2-(4-fluorophenyl)-1-{4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decan-2-yl}ethan-1-one |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C22 H29 F N4 O2 |
| Smiles: | CC(C)Cn1cnnc1C1CN(CC12CCOCC2)C(Cc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3738 |
| logD: | 2.3738 |
| logSw: | -2.4775 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.778 |
| InChI Key: | UWAWQHLZEZZBQU-IBGZPJMESA-N |