prop-2-en-1-yl 7-(4-bromophenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
prop-2-en-1-yl 7-(4-bromophenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate
prop-2-en-1-yl 7-(4-bromophenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | K832-3668 |
| Compound Name: | prop-2-en-1-yl 7-(4-bromophenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 376.21 |
| Molecular Formula: | C15 H14 Br N5 O2 |
| Smiles: | CC1=C(C(c2ccc(cc2)[Br])n2c(N1)nnn2)C(=O)OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9277 |
| logD: | 2.1914 |
| logSw: | -3.1445 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.515 |
| InChI Key: | YLZGKCLFAQEZDW-ZDUSSCGKSA-N |