7-[4-(methylsulfanyl)phenyl]-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid
Chemical Structure Depiction of
7-[4-(methylsulfanyl)phenyl]-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid
7-[4-(methylsulfanyl)phenyl]-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid
Compound characteristics
| Compound ID: | J043-0055 |
| Compound Name: | 7-[4-(methylsulfanyl)phenyl]-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid |
| Molecular Weight: | 289.31 |
| Molecular Formula: | C12 H11 N5 O2 S |
| Smiles: | CSc1ccc(cc1)C1C=C(C(O)=O)Nc2nnnn12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6327 |
| logD: | -1.4926 |
| logSw: | -2.3482 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.757 |
| InChI Key: | VIBFUMNJZSBDHS-JTQLQIEISA-N |