1-bromo-4-chloro-7-(trifluoromethyl)imidazo[1,2-a]quinoxaline

C11H4BrClF3N3 — CID 59333286

IUPAC1-bromo-4-chloro-7-(trifluoromethyl)imidazo[1,2-a]quinoxaline
SMILESFC(F)(F)c1ccc2c(c1)nc(Cl)c1ncc(Br)n12
InChIInChI=1S/C11H4BrClF3N3/c12-8-4-17-10-9(13)18-6-3-5(11(14,15)16)1-2-7(6)19(8)10/h1-4H
InChIKeyNSENBVIMUBECOL-UHFFFAOYSA-N
MW350.53 g/mol
LogP4.32
Rot. Bonds

About 1-bromo-4-chloro-7-(trifluoromethyl)imidazo[1,2-a]quinoxaline

1-bromo-4-chloro-7-(trifluoromethyl)imidazo[1,2-a]quinoxaline (PubChem CID 59333286) has the molecular formula C11H4BrClF3N3 and a molecular weight of 350.53 g/mol. Its IUPAC name is 1-bromo-4-chloro-7-(trifluoromethyl)imidazo[1,2-a]quinoxaline.

Molecular Properties

Compound Name1-bromo-4-chloro-7-(trifluoromethyl)imidazo[1,2-a]quinoxaline
PubChem CID59333286
Molecular FormulaC11H4BrClF3N3
Molecular Weight350.53 g/mol
Exact Mass348.92
IUPAC Name1-bromo-4-chloro-7-(trifluoromethyl)imidazo[1,2-a]quinoxaline
SMILESFC(F)(F)c1ccc2c(c1)nc(Cl)c1ncc(Br)n12
InChIInChI=1S/C11H4BrClF3N3/c12-8-4-17-10-9(13)18-6-3-5(11(14,15)16)1-2-7(6)19(8)10/h1-4H
InChIKeyNSENBVIMUBECOL-UHFFFAOYSA-N
XLogP4.32
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.53
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-bromo-4-chloro-7,8-dimethylimidazo[1,2-a]quinoxaline
CID 71741638
4-chloro-1-(1H-imidazol-2-ylmethyl)-7-(trifluoromethyl)imidazo[1,2-a]quinoxaline-2-carbaldehyde
CID 86752431
3-bromo-2,4-dichloro-6-(trifluoromethyl)quinoline
CID 97181858
1-[2-bromo-5-(trifluoromethyl)phenyl]-5-(trifluoromethyl)benzimidazole
CID 44604521
CID 89240854
CID 89240854
[4-(2-methylpropylamino)-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-1-yl]methanol
CID 141071245
6-(trifluoromethyl)-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazole
CID 91675309
ethyl 4-chloro-7-(trifluoromethyl)imidazo[1,5-a]quinoxaline-3-carboxylate
CID 54209491
3-[[1-ethenyl-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-4-yl]amino]propan-1-ol
CID 25070424
3-[[1-ethynyl-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-4-yl]amino]propan-1-ol
CID 59333283
7-(trifluoromethyl)quinoxalin-2-amine
CID 21313066
2-(2-chloroethyl)-1-(2,2,2-trifluoroethyl)-5-(trifluoromethyl)benzimidazole
CID 115502173

Frequently Asked Questions

What is the IUPAC name of 1-bromo-4-chloro-7-(trifluoromethyl)imidazo[1,2-a]quinoxaline?
The IUPAC name of 1-bromo-4-chloro-7-(trifluoromethyl)imidazo[1,2-a]quinoxaline (CID 59333286) is 1-bromo-4-chloro-7-(trifluoromethyl)imidazo[1,2-a]quinoxaline.
What is the SMILES notation for 1-bromo-4-chloro-7-(trifluoromethyl)imidazo[1,2-a]quinoxaline?
The canonical SMILES for 1-bromo-4-chloro-7-(trifluoromethyl)imidazo[1,2-a]quinoxaline is FC(F)(F)c1ccc2c(c1)nc(Cl)c1ncc(Br)n12.
What is the InChIKey of 1-bromo-4-chloro-7-(trifluoromethyl)imidazo[1,2-a]quinoxaline?
The InChIKey is NSENBVIMUBECOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H4BrClF3N3/c12-8-4-17-10-9(13)18-6-3-5(11(14,15)16)1-2-7(6)19(8)10/h1-4H.
What are the key properties of 1-bromo-4-chloro-7-(trifluoromethyl)imidazo[1,2-a]quinoxaline?
1-bromo-4-chloro-7-(trifluoromethyl)imidazo[1,2-a]quinoxaline has a molecular weight of 350.53 g/mol, XLogP of 4.32, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-4-chloro-7-(trifluoromethyl)imidazo[1,2-a]quinoxaline is sourced from PubChem (CID 59333286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).