1-(4-{3-[6-(4-methylphenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazin-3-yl]-1,2,4-oxadiazol-5-yl}piperidin-1-yl)ethan-1-one
Chemical Structure Depiction of
1-(4-{3-[6-(4-methylphenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazin-3-yl]-1,2,4-oxadiazol-5-yl}piperidin-1-yl)ethan-1-one
1-(4-{3-[6-(4-methylphenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazin-3-yl]-1,2,4-oxadiazol-5-yl}piperidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | S439-0220 |
| Compound Name: | 1-(4-{3-[6-(4-methylphenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazin-3-yl]-1,2,4-oxadiazol-5-yl}piperidin-1-yl)ethan-1-one |
| Molecular Weight: | 408.46 |
| Molecular Formula: | C21 H24 N6 O3 |
| Smiles: | CC(N1CCC(CC1)c1nc(c2c3COC(Cn3nn2)c2ccc(C)cc2)no1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2609 |
| logD: | 2.2609 |
| logSw: | -2.5037 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 83.553 |
| InChI Key: | YGVZMFQQSVLGTN-GOSISDBHSA-N |