7-(3-bromo-4-ethoxy-5-methoxyphenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid
Chemical Structure Depiction of
7-(3-bromo-4-ethoxy-5-methoxyphenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid
7-(3-bromo-4-ethoxy-5-methoxyphenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid
Compound characteristics
| Compound ID: | J043-0051 |
| Compound Name: | 7-(3-bromo-4-ethoxy-5-methoxyphenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid |
| Molecular Weight: | 396.2 |
| Molecular Formula: | C14 H14 Br N5 O4 |
| Smiles: | CCOc1c(cc(cc1[Br])C1C=C(C(O)=O)Nc2nnnn12)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8357 |
| logD: | -1.2896 |
| logSw: | -2.3376 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.684 |
| InChI Key: | FTHMXWFWLPUYEZ-JTQLQIEISA-N |