N-(2H-1,3-benzodioxol-5-yl)-5-(3-phenyl-1,2,4-oxadiazol-5-yl)pyrimidin-4-amine
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-5-(3-phenyl-1,2,4-oxadiazol-5-yl)pyrimidin-4-amine
N-(2H-1,3-benzodioxol-5-yl)-5-(3-phenyl-1,2,4-oxadiazol-5-yl)pyrimidin-4-amine
Compound characteristics
| Compound ID: | S538-0022 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-5-(3-phenyl-1,2,4-oxadiazol-5-yl)pyrimidin-4-amine |
| Molecular Weight: | 359.34 |
| Molecular Formula: | C19 H13 N5 O3 |
| Smiles: | C1Oc2ccc(cc2O1)Nc1c(cncn1)c1nc(c2ccccc2)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.9484 |
| logD: | 3.8948 |
| logSw: | -4.0059 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.592 |
| InChI Key: | MDBWMZSWQGAEGS-UHFFFAOYSA-N |