3-[(4-nitrophenyl)carbamoyl]pyrazine-2-carboxylic acid
Chemical Structure Depiction of
3-[(4-nitrophenyl)carbamoyl]pyrazine-2-carboxylic acid
3-[(4-nitrophenyl)carbamoyl]pyrazine-2-carboxylic acid
Compound characteristics
| Compound ID: | C612-1047 |
| Compound Name: | 3-[(4-nitrophenyl)carbamoyl]pyrazine-2-carboxylic acid |
| Molecular Weight: | 288.22 |
| Molecular Formula: | C12 H8 N4 O5 |
| Smiles: | c1cc(ccc1NC(c1c(C(O)=O)nccn1)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.4969 |
| logD: | -4.9489 |
| logSw: | -1.8965 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.756 |
| InChI Key: | QEWJHXVLLSXAGW-UHFFFAOYSA-N |