7-[4-(methoxycarbonyl)phenyl]-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid
Chemical Structure Depiction of
7-[4-(methoxycarbonyl)phenyl]-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid
7-[4-(methoxycarbonyl)phenyl]-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid
Compound characteristics
| Compound ID: | J043-0060 |
| Compound Name: | 7-[4-(methoxycarbonyl)phenyl]-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid |
| Molecular Weight: | 301.26 |
| Molecular Formula: | C13 H11 N5 O4 |
| Smiles: | COC(c1ccc(cc1)C1C=C(C(O)=O)Nc2nnnn12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0041 |
| logD: | -2.1212 |
| logSw: | -1.9133 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.93 |
| InChI Key: | FXDUNRNYHQWTKA-JTQLQIEISA-N |