N-(2H-1,3-benzodioxol-5-yl)-4-chloro-3-methyl-1,2-oxazole-5-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-4-chloro-3-methyl-1,2-oxazole-5-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-4-chloro-3-methyl-1,2-oxazole-5-carboxamide
Compound characteristics
| Compound ID: | C625-0125 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-4-chloro-3-methyl-1,2-oxazole-5-carboxamide |
| Molecular Weight: | 280.66 |
| Molecular Formula: | C12 H9 Cl N2 O4 |
| Smiles: | Cc1c(c(C(Nc2ccc3c(c2)OCO3)=O)on1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.5858 |
| logD: | 2.5733 |
| logSw: | -3.7351 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.062 |
| InChI Key: | WQULTWTVUDEJOG-UHFFFAOYSA-N |