AC1NYSHU
2-[7-(4-chlorophenyl)-5-phenyl-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione
Also Known As: 2-(7-(4-chlorophenyl)-5-phenyl-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione|2-[7-(4-chlorophenyl)-5-phenyl-1,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione|2-[7-(4-chlorophenyl)-5-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C25H22ClN5O2 |
|---|---|
| Molecular Weight | 459.1462 g/mol |
| LogP | 4.5334 |
| Topological Polar Surface Area | 80.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 459.1462 |
| Monoisotopic Mass | 459.1462 |
| Heavy Atoms | 33 |
| Complexity | 1227.5615 |
Chemical Identifiers
| CAS Number | 1024562-64-8 |
|---|---|
| SMILES | C1C=CCC2C1C(=O)N(C2=O)C3=NN4C(CC(NC4=N3)C5=CC=CC=C5)C6=CC=C(C=C6)Cl |
Product Overview
AC1NYSHU (CAS 1024562-64-8), with molecular formula C25H22ClN5O2 and molecular weight 459.1462 g/mol. IUPAC: 2-[7-(4-chlorophenyl)-5-phenyl-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione.
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