3-(3,4-dichlorophenyl)-2-(4-fluorophenyl)-1H-imidazo[4,5-b]quinoxalin-3-ium

Formula:C21H12N4Cl2F Mutagenic:low Tumorigenic:none Reproductive Effective:none 3-(3,4-dichlorophenyl)-2-(4-fluorophenyl)-1H-imidazo[4,5-b]quinoxalin-3-ium is a drug-like molecule.

MolName	3-(3,4-dichlorophenyl)-2-(4-fluorophenyl)-1H-imidazo[4,5-b]quinoxalin-3-ium
MolecularFormula	C21H12N4Cl2F
Smiles	Fc(cc1)ccc1-c([nH]c1nc2ccccc2nc11)[n+]1-c(cc1)cc(Cl)c1Cl
InChI	InChI=1S/C21H11Cl2FN4/c22-15-10-9-14(11-16(15)23)28-20(12-5-7-13(24)8-6-12)27-19-21(28)26-18-4-2-1-3-17(18)25-19/h1-11H/p+1
InChIK	MMAJTKCIBUGGFG-UHFFFAOYSA-O
TotalMolweight	410.258
Molweight	410.258
MonoisotopicMass	409.042303
CLogP	4.8797
CLogS	-10.543
H Acceptors	4
H Donors	1
TotalSurfaceArea	283.56
Relative PSA	0.13644
PolarSurfaceArea	45.45
Druglikeness	-2.1808
Mutagenic	low
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	tert. immonium
Shape Index	0.42857
Fragments	1
Non HAtoms	28
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	2
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	25
Symmetricatoms	2
Aromatic Nitrogens	4
StereoCon

Click to Load Molecule:

1 - 3-(3,4-dichlorophenyl)-2-(4-fluorophenyl)-1H-imidazo[4,5-b]quinoxalin-3-ium | 2 - 3-(3,4-dichlorophenyl)-2-(4-fluorophenyl)-1H-imidazo[4,5-b]quinoxalin-3-ium

Request More Details | 3-(3,4-dichlorophenyl)-2-(4-fluorophenyl)-1H-imidazo[4,5-b]quinoxalin-3-ium

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments