N-(4-chloro-2,5-dimethoxyphenyl)-5-methyl-4-nitro-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-(4-chloro-2,5-dimethoxyphenyl)-5-methyl-4-nitro-1,2-oxazole-3-carboxamide
N-(4-chloro-2,5-dimethoxyphenyl)-5-methyl-4-nitro-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C582-0776 |
| Compound Name: | N-(4-chloro-2,5-dimethoxyphenyl)-5-methyl-4-nitro-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 341.71 |
| Molecular Formula: | C13 H12 Cl N3 O6 |
| Smiles: | Cc1c(c(C(Nc2cc(c(cc2OC)[Cl])OC)=O)no1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.5773 |
| logD: | 0.6548 |
| logSw: | -3.3941 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.904 |
| InChI Key: | CVOJBCLIWZWWNK-UHFFFAOYSA-N |