AC1MY0KJ structure

AC1MY0KJ

4-(4-chloro-3-fluorophenyl)-7-(4-chlorophenyl)-1,4,8-triazatricyclo[6.3.0.02,6]undecane-3,5-dione

Also Known As: A3562/0151119|2-(4-chloro-3-fluorophenyl)-9-(4-chlorophenyl)tetrahydro-5H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H,3aH)-dione|2-(4-chloro-3-fluorophenyl)-9-(4-chlorophenyl)hexahydro-1H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H)-dione

CAS: 459147-68-3
Molecular Formula C20H16Cl2FN3O2
Molecular Weight 419.06036 g/mol
LogP 3.6681
Topological Polar Surface Area 43.86 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 2
Exact Mass 419.06036
Monoisotopic Mass 419.06036
Heavy Atoms 28
Complexity 983.91614

Chemical Identifiers

CAS Number 459147-68-3
SMILES C1CN2C(C3C(N2C1)C(=O)N(C3=O)C4=CC(=C(C=C4)Cl)F)C5=CC=C(C=C5)Cl

Product Overview

AC1MY0KJ (CAS 459147-68-3), with molecular formula C20H16Cl2FN3O2 and molecular weight 419.06036 g/mol. IUPAC: 4-(4-chloro-3-fluorophenyl)-7-(4-chlorophenyl)-1,4,8-triazatricyclo[6.3.0.02,6]undecane-3,5-dione.

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