7-(4-methyl-3-nitrophenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid
Chemical Structure Depiction of
7-(4-methyl-3-nitrophenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid
7-(4-methyl-3-nitrophenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid
Compound characteristics
| Compound ID: | J043-0016 |
| Compound Name: | 7-(4-methyl-3-nitrophenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid |
| Molecular Weight: | 302.25 |
| Molecular Formula: | C12 H10 N6 O4 |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C1C=C(C(O)=O)Nc2nnnn12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2772 |
| logD: | -1.8481 |
| logSw: | -2.1144 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 114.837 |
| InChI Key: | WNPODPRYUDORGA-JTQLQIEISA-N |