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

C16H9BrClN3 — CID 57402991

IUPAC7-bromo-2-(3-chlorophenyl)-3H-imidazo[4,5-c]quinoline
SMILESClc1cccc(-c2nc3c(cnc4cc(Br)ccc43)[nH]2)c1
InChIInChI=1S/C16H9BrClN3/c17-10-4-5-12-13(7-10)19-8-14-15(12)21-16(20-14)9-2-1-3-11(18)6-9/h1-8H,(H,20,21)
InChIKeyDFIZKEWOQFORTP-UHFFFAOYSA-N
MW358.63 g/mol
LogP5.19
Rot. Bonds1

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

7-bromo-2-(3-chlorophenyl)-3H-imidazo[4,5-c]quinoline (PubChem CID 57402991) has the molecular formula C16H9BrClN3 and a molecular weight of 358.63 g/mol. Its IUPAC name is 7-bromo-2-(3-chlorophenyl)-3H-imidazo[4,5-c]quinoline.

Molecular Properties

Compound Name7-bromo-2-(3-chlorophenyl)-3H-imidazo[4,5-c]quinoline
PubChem CID57402991
Molecular FormulaC16H9BrClN3
Molecular Weight358.63 g/mol
Exact Mass356.97
IUPAC Name7-bromo-2-(3-chlorophenyl)-3H-imidazo[4,5-c]quinoline
SMILESClc1cccc(-c2nc3c(cnc4cc(Br)ccc43)[nH]2)c1
InChIInChI=1S/C16H9BrClN3/c17-10-4-5-12-13(7-10)19-8-14-15(12)21-16(20-14)9-2-1-3-11(18)6-9/h1-8H,(H,20,21)
InChIKeyDFIZKEWOQFORTP-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

N-(3-bromophenyl)-8H-pyrrolo[3,2-g]quinazolin-4-amine
CID 5328243
N-(3-bromophenyl)-6-chloropyrido[3,4-d]pyrimidin-4-amine
CID 5328259
Nortopsentin C
CID 456386
Nortopsentin B
CID 456387
Pyrido[4,3-d]pyrimidine deriv. 3z
CID 5328320
4-N-(3-bromophenyl)-6-N-[2-(1H-imidazol-4-yl)ethyl]pyrido[3,4-d]pyrimidine-4,6-diamine
CID 5328367
N-(3-bromophenyl)-5H-pyrimido[5,4-b]indol-4-amine
CID 5328385
2-(4-chlorophenyl)-3H-imidazo[4,5-c]quinoline
CID 10540663
2-Phenylimidazo[4,5-c]quinoline
CID 10824264
N-(3-bromophenyl)-6-chloroquinazolin-4-amine
CID 11056756
8-bromo-4-[(3-chloro-4-fluorophenyl)amino]-6-[(1H-imidazol-4-ylmethyl)amino]quinoline-3-carbonitrile
CID 17758241
1H-Imidazo(4,5-c)pyridine, 2-(4-chlorophenyl)-
CID 153617

Frequently Asked Questions

What is the IUPAC name of 7-bromo-2-(3-chlorophenyl)-3H-imidazo[4,5-c]quinoline?
The IUPAC name of 7-bromo-2-(3-chlorophenyl)-3H-imidazo[4,5-c]quinoline (CID 57402991) is 7-bromo-2-(3-chlorophenyl)-3H-imidazo[4,5-c]quinoline.
What is the SMILES notation for 7-bromo-2-(3-chlorophenyl)-3H-imidazo[4,5-c]quinoline?
The canonical SMILES for 7-bromo-2-(3-chlorophenyl)-3H-imidazo[4,5-c]quinoline is Clc1cccc(-c2nc3c(cnc4cc(Br)ccc43)[nH]2)c1.
What is the InChIKey of 7-bromo-2-(3-chlorophenyl)-3H-imidazo[4,5-c]quinoline?
The InChIKey is DFIZKEWOQFORTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H9BrClN3/c17-10-4-5-12-13(7-10)19-8-14-15(12)21-16(20-14)9-2-1-3-11(18)6-9/h1-8H,(H,20,21).
What are the key properties of 7-bromo-2-(3-chlorophenyl)-3H-imidazo[4,5-c]quinoline?
7-bromo-2-(3-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-(3-chlorophenyl)-3H-imidazo[4,5-c]quinoline is sourced from PubChem (CID 57402991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).