2-(4-bromophenyl)-1-phenylimidazo[1,2-a]quinoline

C23H15BrN2 — CID 177296975

IUPAC2-(4-bromophenyl)-1-phenylimidazo[1,2-a]quinoline
SMILESBrc1ccc(-c2nc3ccc4ccccc4n3c2-c2ccccc2)cc1
InChIInChI=1S/C23H15BrN2/c24-19-13-10-17(11-14-19)22-23(18-7-2-1-3-8-18)26-20-9-5-4-6-16(20)12-15-21(26)25-22/h1-15H
InChIKeyUVBYFEJHHPHDBK-UHFFFAOYSA-N
MW399.29 g/mol
LogP6.58
Rot. Bonds2

About 2-(4-bromophenyl)-1-phenylimidazo[1,2-a]quinoline

2-(4-bromophenyl)-1-phenylimidazo[1,2-a]quinoline (PubChem CID 177296975) has the molecular formula C23H15BrN2 and a molecular weight of 399.29 g/mol. Its IUPAC name is 2-(4-bromophenyl)-1-phenylimidazo[1,2-a]quinoline.

Molecular Properties

Compound Name2-(4-bromophenyl)-1-phenylimidazo[1,2-a]quinoline
PubChem CID177296975
Molecular FormulaC23H15BrN2
Molecular Weight399.29 g/mol
Exact Mass398.04
IUPAC Name2-(4-bromophenyl)-1-phenylimidazo[1,2-a]quinoline
SMILESBrc1ccc(-c2nc3ccc4ccccc4n3c2-c2ccccc2)cc1
InChIInChI=1S/C23H15BrN2/c24-19-13-10-17(11-14-19)22-23(18-7-2-1-3-8-18)26-20-9-5-4-6-16(20)12-15-21(26)25-22/h1-15H
InChIKeyUVBYFEJHHPHDBK-UHFFFAOYSA-N
XLogP6.58
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500399.29
LogP ≤ 56.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-1-phenylimidazo[1,2-a]quinoline?
The IUPAC name of 2-(4-bromophenyl)-1-phenylimidazo[1,2-a]quinoline (CID 177296975) is 2-(4-bromophenyl)-1-phenylimidazo[1,2-a]quinoline.
What is the SMILES notation for 2-(4-bromophenyl)-1-phenylimidazo[1,2-a]quinoline?
The canonical SMILES for 2-(4-bromophenyl)-1-phenylimidazo[1,2-a]quinoline is Brc1ccc(-c2nc3ccc4ccccc4n3c2-c2ccccc2)cc1.
What is the InChIKey of 2-(4-bromophenyl)-1-phenylimidazo[1,2-a]quinoline?
The InChIKey is UVBYFEJHHPHDBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15BrN2/c24-19-13-10-17(11-14-19)22-23(18-7-2-1-3-8-18)26-20-9-5-4-6-16(20)12-15-21(26)25-22/h1-15H.
What are the key properties of 2-(4-bromophenyl)-1-phenylimidazo[1,2-a]quinoline?
2-(4-bromophenyl)-1-phenylimidazo[1,2-a]quinoline has a molecular weight of 399.29 g/mol, XLogP of 6.58, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-1-phenylimidazo[1,2-a]quinoline is sourced from PubChem (CID 177296975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).