(2H-1,3-benzodioxol-5-yl){3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}methanone
Chemical Structure Depiction of
(2H-1,3-benzodioxol-5-yl){3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}methanone
(2H-1,3-benzodioxol-5-yl){3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}methanone
Compound characteristics
| Compound ID: | S457-0257 |
| Compound Name: | (2H-1,3-benzodioxol-5-yl){3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}methanone |
| Molecular Weight: | 444.45 |
| Molecular Formula: | C23 H20 N6 O4 |
| Smiles: | C1CC(CN(C1)C(c1ccc2c(c1)OCO2)=O)n1cc(c2nc(c3ccccc3)no2)nn1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0173 |
| logD: | 3.0173 |
| logSw: | -3.1599 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 91.348 |
| InChI Key: | RKGXHAAVQHIZDV-KRWDZBQOSA-N |