prop-2-en-1-yl 7-(5-bromo-2-methoxyphenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
prop-2-en-1-yl 7-(5-bromo-2-methoxyphenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate
prop-2-en-1-yl 7-(5-bromo-2-methoxyphenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | F103-0247 |
| Compound Name: | prop-2-en-1-yl 7-(5-bromo-2-methoxyphenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 406.24 |
| Molecular Formula: | C16 H16 Br N5 O3 |
| Smiles: | CC1=C(C(c2cc(ccc2OC)[Br])n2c(N1)nnn2)C(=O)OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0091 |
| logD: | 2.2727 |
| logSw: | -3.2802 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.145 |
| InChI Key: | PYGSJLUVWUMEDS-AWEZNQCLSA-N |