4-(4-cyclopropyl-4H-1,2,4-triazol-3-yl)-2-{[2-(trifluoromethyl)phenyl]methyl}-8-oxa-2-azaspiro[4.5]decane
Chemical Structure Depiction of
4-(4-cyclopropyl-4H-1,2,4-triazol-3-yl)-2-{[2-(trifluoromethyl)phenyl]methyl}-8-oxa-2-azaspiro[4.5]decane
4-(4-cyclopropyl-4H-1,2,4-triazol-3-yl)-2-{[2-(trifluoromethyl)phenyl]methyl}-8-oxa-2-azaspiro[4.5]decane
Compound characteristics
| Compound ID: | SC66-0384 |
| Compound Name: | 4-(4-cyclopropyl-4H-1,2,4-triazol-3-yl)-2-{[2-(trifluoromethyl)phenyl]methyl}-8-oxa-2-azaspiro[4.5]decane |
| Molecular Weight: | 406.45 |
| Molecular Formula: | C21 H25 F3 N4 O |
| Smiles: | C1CC1n1cnnc1C1CN(Cc2ccccc2C(F)(F)F)CC12CCOCC2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.02 |
| logD: | 1.8539 |
| logSw: | -3.2863 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.741 |
| InChI Key: | SWMCCJVYXPQAOP-SFHVURJKSA-N |