5-{[(2H-1,3-benzodioxol-4-yl)methyl]amino}-3-methyl-N-[3-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide
Chemical Structure Depiction of
5-{[(2H-1,3-benzodioxol-4-yl)methyl]amino}-3-methyl-N-[3-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide
5-{[(2H-1,3-benzodioxol-4-yl)methyl]amino}-3-methyl-N-[3-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | H024-0075 |
| Compound Name: | 5-{[(2H-1,3-benzodioxol-4-yl)methyl]amino}-3-methyl-N-[3-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide |
| Molecular Weight: | 419.36 |
| Molecular Formula: | C20 H16 F3 N3 O4 |
| Smiles: | Cc1c(C(Nc2cccc(c2)C(F)(F)F)=O)c(NCc2cccc3c2OCO3)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.3083 |
| logD: | 4.2996 |
| logSw: | -4.5501 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.028 |
| InChI Key: | IVICYUYCPSGDAQ-UHFFFAOYSA-N |