3-[(4-carboxyphenyl)carbamoyl]pyrazine-2-carboxylic acid
Chemical Structure Depiction of
3-[(4-carboxyphenyl)carbamoyl]pyrazine-2-carboxylic acid
3-[(4-carboxyphenyl)carbamoyl]pyrazine-2-carboxylic acid
Compound characteristics
| Compound ID: | 0640-0226 |
| Compound Name: | 3-[(4-carboxyphenyl)carbamoyl]pyrazine-2-carboxylic acid |
| Molecular Weight: | 287.23 |
| Molecular Formula: | C13 H9 N3 O5 |
| Smiles: | c1cc(ccc1C(O)=O)NC(c1c(C(O)=O)nccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4195 |
| logD: | -5.0263 |
| logSw: | -1.5696 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.783 |
| InChI Key: | BJQMZEDTXXPBFN-UHFFFAOYSA-N |