methyl 7-(4-ethoxyphenyl)-6-(3-phenylprop-2-enoyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 7-(4-ethoxyphenyl)-6-(3-phenylprop-2-enoyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylate
methyl 7-(4-ethoxyphenyl)-6-(3-phenylprop-2-enoyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8020-3505 |
| Compound Name: | methyl 7-(4-ethoxyphenyl)-6-(3-phenylprop-2-enoyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylate |
| Molecular Weight: | 431.45 |
| Molecular Formula: | C23 H21 N5 O4 |
| Smiles: | CCOc1ccc(cc1)C1C(=C(C(=O)OC)Nc2nnnn12)C(/C=C/c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6909 |
| logD: | 1.9103 |
| logSw: | -3.8983 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.241 |
| InChI Key: | GKIWVYQYGWDRTK-OAQYLSRUSA-N |