N-{4-[4-(2-methylpropoxy)phenyl]-1,2,5-oxadiazol-3-yl}-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-{4-[4-(2-methylpropoxy)phenyl]-1,2,5-oxadiazol-3-yl}-2-oxo-2H-1-benzopyran-3-carboxamide
N-{4-[4-(2-methylpropoxy)phenyl]-1,2,5-oxadiazol-3-yl}-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | D269-1235 |
| Compound Name: | N-{4-[4-(2-methylpropoxy)phenyl]-1,2,5-oxadiazol-3-yl}-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 405.41 |
| Molecular Formula: | C22 H19 N3 O5 |
| Smiles: | [H]N(C(C1=Cc2ccccc2OC1=O)=O)c1c(c2ccc(cc2)OCC(C)C)non1 |
| Stereo: | ACHIRAL |
| logP: | 4.7253 |
| logD: | 3.9505 |
| logSw: | -4.4603 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.507 |
| InChI Key: | QZWOKJBQKOONJP-UHFFFAOYSA-N |