7-(3-bromo-4-methoxyphenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid
Chemical Structure Depiction of
7-(3-bromo-4-methoxyphenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid
7-(3-bromo-4-methoxyphenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid
Compound characteristics
| Compound ID: | J043-0057 |
| Compound Name: | 7-(3-bromo-4-methoxyphenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid |
| Molecular Weight: | 352.14 |
| Molecular Formula: | C12 H10 Br N5 O3 |
| Smiles: | COc1ccc(cc1[Br])C1C=C(C(O)=O)Nc2nnnn12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.295 |
| logD: | -1.8303 |
| logSw: | -2.0387 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.387 |
| InChI Key: | KVJHSGBIQQTXCJ-VIFPVBQESA-N |