AC1NWSIC
benzyl 7-(4-hydroxyphenyl)-5-methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Also Known As: Oprea1_517449|Oprea1_518517|AB00685455-01|SR-01000010062-1|benzyl 7-(4-hydroxyphenyl)-5-methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate|F1038-0520|benzyl 7-(4-hydroxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate|benzyl 7-(4-hydroxyphenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate|phenylmethyl 7-(4-hydroxyphenyl)-5-methyl-4,7,8-trihydro-1,2,4-triazolo[1,5-a] pyrimidine-6-carboxylate
| Molecular Formula | C20H18N4O3 |
|---|---|
| Molecular Weight | 362.13788 g/mol |
| LogP | 3.016 |
| Topological Polar Surface Area | 89.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 362.13788 |
| Monoisotopic Mass | 362.13788 |
| Heavy Atoms | 27 |
| Complexity | 993.581 |
Chemical Identifiers
| CAS Number | 457950-91-3 |
|---|---|
| SMILES | CC1=C(C(N2C(=NC=N2)N1)C3=CC=C(C=C3)O)C(=O)OCC4=CC=CC=C4 |
Product Overview
AC1NWSIC (CAS 457950-91-3), with molecular formula C20H18N4O3 and molecular weight 362.13788 g/mol. IUPAC: benzyl 7-(4-hydroxyphenyl)-5-methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate.
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