AC1NYC47

2-[7-(4-chlorophenyl)-5-(4-methoxyphenyl)-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-(4-methoxyphenyl)-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-(4-methoxyphenyl)-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-(4-methoxyphenyl)-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	C26H24ClN5O3
Molecular Weight	489.15677 g/mol
LogP	4.542
Topological Polar Surface Area	89.35 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	4
Exact Mass	489.15677
Monoisotopic Mass	489.15677
Heavy Atoms	35
Complexity	1291.7601

Chemical Identifiers

CAS Number	1024573-12-3
SMILES	COC1=CC=C(C=C1)C2CC(N3C(=NC(=N3)N4C(=O)C5CC=CCC5C4=O)N2)C6=CC=C(C=C6)Cl