N-(4-chloro-2,5-dimethoxyphenyl)-5-nitrofuran-2-carboxamide
Chemical Structure Depiction of
N-(4-chloro-2,5-dimethoxyphenyl)-5-nitrofuran-2-carboxamide
N-(4-chloro-2,5-dimethoxyphenyl)-5-nitrofuran-2-carboxamide
Compound characteristics
| Compound ID: | Y031-8346 |
| Compound Name: | N-(4-chloro-2,5-dimethoxyphenyl)-5-nitrofuran-2-carboxamide |
| Molecular Weight: | 326.69 |
| Molecular Formula: | C13 H11 Cl N2 O6 |
| Smiles: | COc1cc(c(cc1NC(c1ccc([N+]([O-])=O)o1)=O)OC)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.7224 |
| logD: | 1.4283 |
| logSw: | -3.6256 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.553 |
| InChI Key: | JQCASTAWRSTPRW-UHFFFAOYSA-N |