7-(3-bromo-4-hydroxy-5-methoxyphenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid
Chemical Structure Depiction of
7-(3-bromo-4-hydroxy-5-methoxyphenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid
7-(3-bromo-4-hydroxy-5-methoxyphenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid
Compound characteristics
| Compound ID: | J043-0036 |
| Compound Name: | 7-(3-bromo-4-hydroxy-5-methoxyphenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid |
| Molecular Weight: | 368.14 |
| Molecular Formula: | C12 H10 Br N5 O4 |
| Smiles: | COc1cc(cc(c1O)[Br])C1C=C(C(O)=O)Nc2nnnn12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8174 |
| logD: | -2.3079 |
| logSw: | -1.8901 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.866 |
| InChI Key: | JYINNPFIOWEFRR-QMMMGPOBSA-N |