5-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-{4-[chloro(difluoro)methoxy]phenyl}-3-methyl-1,2-oxazole-4-carboxamide
Chemical Structure Depiction of
5-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-{4-[chloro(difluoro)methoxy]phenyl}-3-methyl-1,2-oxazole-4-carboxamide
5-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-{4-[chloro(difluoro)methoxy]phenyl}-3-methyl-1,2-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | H024-0092 |
| Compound Name: | 5-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-{4-[chloro(difluoro)methoxy]phenyl}-3-methyl-1,2-oxazole-4-carboxamide |
| Molecular Weight: | 451.81 |
| Molecular Formula: | C20 H16 Cl F2 N3 O5 |
| Smiles: | Cc1c(C(Nc2ccc(cc2)OC(F)(F)[Cl])=O)c(NCc2ccc3c(c2)OCO3)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.9886 |
| logD: | 3.9885 |
| logSw: | -4.8392 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.841 |
| InChI Key: | KSXGAACTSZVQBL-UHFFFAOYSA-N |