(4-nitrophenyl)methyl 7-(4-hydroxyphenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
(4-nitrophenyl)methyl 7-(4-hydroxyphenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate
(4-nitrophenyl)methyl 7-(4-hydroxyphenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | C550-0217 |
| Compound Name: | (4-nitrophenyl)methyl 7-(4-hydroxyphenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 408.37 |
| Molecular Formula: | C19 H16 N6 O5 |
| Smiles: | CC1=C(C(c2ccc(cc2)O)n2c(N1)nnn2)C(=O)OCc1ccc(cc1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4691 |
| logD: | 1.7328 |
| logSw: | -2.8155 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 124.323 |
| InChI Key: | JOZCEYJPXBFWDU-KRWDZBQOSA-N |