N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(3-phenyl-1,2,4-oxadiazol-5-yl)pyrimidin-4-amine
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(3-phenyl-1,2,4-oxadiazol-5-yl)pyrimidin-4-amine
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(3-phenyl-1,2,4-oxadiazol-5-yl)pyrimidin-4-amine
Compound characteristics
| Compound ID: | S538-0407 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(3-phenyl-1,2,4-oxadiazol-5-yl)pyrimidin-4-amine |
| Molecular Weight: | 373.37 |
| Molecular Formula: | C20 H15 N5 O3 |
| Smiles: | [H]N(Cc1ccc2c(c1)OCO2)c1c(cncn1)c1nc(c2ccccc2)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.5982 |
| logD: | 3.5638 |
| logSw: | -3.5934 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.914 |
| InChI Key: | YWEHMMUEQNGRHF-UHFFFAOYSA-N |