2-(4,6-dichloro-1H-benzimidazol-2-yl)quinoxaline

C15H8Cl2N4 — CID 11536947

IUPAC2-(4,6-dichloro-1H-benzimidazol-2-yl)quinoxaline
SMILESClc1cc(Cl)c2nc(-c3cnc4ccccc4n3)[nH]c2c1
InChIInChI=1S/C15H8Cl2N4/c16-8-5-9(17)14-12(6-8)20-15(21-14)13-7-18-10-3-1-2-4-11(10)19-13/h1-7H,(H,20,21)
InChIKeyWDSMKZXZLZTCFS-UHFFFAOYSA-N
MW315.16 g/mol
LogP4.48
Rot. Bonds1

About 2-(4,6-dichloro-1H-benzimidazol-2-yl)quinoxaline

2-(4,6-dichloro-1H-benzimidazol-2-yl)quinoxaline (PubChem CID 11536947) has the molecular formula C15H8Cl2N4 and a molecular weight of 315.16 g/mol. Its IUPAC name is 2-(4,6-dichloro-1H-benzimidazol-2-yl)quinoxaline.

Molecular Properties

Compound Name2-(4,6-dichloro-1H-benzimidazol-2-yl)quinoxaline
PubChem CID11536947
Molecular FormulaC15H8Cl2N4
Molecular Weight315.16 g/mol
Exact Mass314.01
IUPAC Name2-(4,6-dichloro-1H-benzimidazol-2-yl)quinoxaline
SMILESClc1cc(Cl)c2nc(-c3cnc4ccccc4n3)[nH]c2c1
InChIInChI=1S/C15H8Cl2N4/c16-8-5-9(17)14-12(6-8)20-15(21-14)13-7-18-10-3-1-2-4-11(10)19-13/h1-7H,(H,20,21)
InChIKeyWDSMKZXZLZTCFS-UHFFFAOYSA-N
XLogP4.48
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.16
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4,6-dichloro-1H-benzimidazol-2-yl)quinoxaline?
The IUPAC name of 2-(4,6-dichloro-1H-benzimidazol-2-yl)quinoxaline (CID 11536947) is 2-(4,6-dichloro-1H-benzimidazol-2-yl)quinoxaline.
What is the SMILES notation for 2-(4,6-dichloro-1H-benzimidazol-2-yl)quinoxaline?
The canonical SMILES for 2-(4,6-dichloro-1H-benzimidazol-2-yl)quinoxaline is Clc1cc(Cl)c2nc(-c3cnc4ccccc4n3)[nH]c2c1.
What is the InChIKey of 2-(4,6-dichloro-1H-benzimidazol-2-yl)quinoxaline?
The InChIKey is WDSMKZXZLZTCFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8Cl2N4/c16-8-5-9(17)14-12(6-8)20-15(21-14)13-7-18-10-3-1-2-4-11(10)19-13/h1-7H,(H,20,21).
What are the key properties of 2-(4,6-dichloro-1H-benzimidazol-2-yl)quinoxaline?
2-(4,6-dichloro-1H-benzimidazol-2-yl)quinoxaline has a molecular weight of 315.16 g/mol, XLogP of 4.48, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,6-dichloro-1H-benzimidazol-2-yl)quinoxaline is sourced from PubChem (CID 11536947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).