(2H-1,3-benzodioxol-5-yl){4-[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){4-[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){4-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}methanone
Compound characteristics
| Compound ID: | S454-0913 |
| Compound Name: | (2H-1,3-benzodioxol-5-yl){4-[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: | C1CN(CCC1n1cc(c2nc(c3ccccc3)no2)nn1)C(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3096 |
| logD: | 3.3096 |
| logSw: | -3.4506 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 91.414 |
| InChI Key: | DXALAWBUKWWXKQ-UHFFFAOYSA-N |