7-bromo-2-(4-chlorophenyl)-3H-imidazo[4,5-c]quinoline

C16H9BrClN3 — CID 57392544

IUPAC7-bromo-2-(4-chlorophenyl)-3H-imidazo[4,5-c]quinoline
SMILESClc1ccc(-c2nc3c(cnc4cc(Br)ccc43)[nH]2)cc1
InChIInChI=1S/C16H9BrClN3/c17-10-3-6-12-13(7-10)19-8-14-15(12)21-16(20-14)9-1-4-11(18)5-2-9/h1-8H,(H,20,21)
InChIKeyLQZLGYSSMDMQJY-UHFFFAOYSA-N
MW358.63 g/mol
LogP5.19
Rot. Bonds1

About 7-bromo-2-(4-chlorophenyl)-3H-imidazo[4,5-c]quinoline

7-bromo-2-(4-chlorophenyl)-3H-imidazo[4,5-c]quinoline (PubChem CID 57392544) has the molecular formula C16H9BrClN3 and a molecular weight of 358.63 g/mol. Its IUPAC name is 7-bromo-2-(4-chlorophenyl)-3H-imidazo[4,5-c]quinoline.

Molecular Properties

Compound Name7-bromo-2-(4-chlorophenyl)-3H-imidazo[4,5-c]quinoline
PubChem CID57392544
Molecular FormulaC16H9BrClN3
Molecular Weight358.63 g/mol
Exact Mass356.97
IUPAC Name7-bromo-2-(4-chlorophenyl)-3H-imidazo[4,5-c]quinoline
SMILESClc1ccc(-c2nc3c(cnc4cc(Br)ccc43)[nH]2)cc1
InChIInChI=1S/C16H9BrClN3/c17-10-3-6-12-13(7-10)19-8-14-15(12)21-16(20-14)9-1-4-11(18)5-2-9/h1-8H,(H,20,21)
InChIKeyLQZLGYSSMDMQJY-UHFFFAOYSA-N
XLogP5.19
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.63
LogP ≤ 55.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

CID 5328243
CID 5328243
CID 5328259
CID 5328259
CID 456386
CID 456386
CID 456387
CID 456387
CID 5328320
CID 5328320
CID 5328367
CID 5328367
CID 5328385
CID 5328385
CID 6538792
CID 6538792
CID 6538794
CID 6538794
CID 10540663
CID 10540663
CID 10824264
CID 10824264
CID 17758241
CID 17758241

Frequently Asked Questions

What is the IUPAC name of 7-bromo-2-(4-chlorophenyl)-3H-imidazo[4,5-c]quinoline?
The IUPAC name of 7-bromo-2-(4-chlorophenyl)-3H-imidazo[4,5-c]quinoline (CID 57392544) is 7-bromo-2-(4-chlorophenyl)-3H-imidazo[4,5-c]quinoline.
What is the SMILES notation for 7-bromo-2-(4-chlorophenyl)-3H-imidazo[4,5-c]quinoline?
The canonical SMILES for 7-bromo-2-(4-chlorophenyl)-3H-imidazo[4,5-c]quinoline is Clc1ccc(-c2nc3c(cnc4cc(Br)ccc43)[nH]2)cc1.
What is the InChIKey of 7-bromo-2-(4-chlorophenyl)-3H-imidazo[4,5-c]quinoline?
The InChIKey is LQZLGYSSMDMQJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H9BrClN3/c17-10-3-6-12-13(7-10)19-8-14-15(12)21-16(20-14)9-1-4-11(18)5-2-9/h1-8H,(H,20,21).
What are the key properties of 7-bromo-2-(4-chlorophenyl)-3H-imidazo[4,5-c]quinoline?
7-bromo-2-(4-chlorophenyl)-3H-imidazo[4,5-c]quinoline has a molecular weight of 358.63 g/mol, XLogP of 5.19, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-2-(4-chlorophenyl)-3H-imidazo[4,5-c]quinoline is sourced from PubChem (CID 57392544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).