1-(2,3-dichlorophenyl)benzimidazole

C13H8Cl2N2 — CID 42636654

IUPAC1-(2,3-dichlorophenyl)benzimidazole
SMILESClc1cccc(-n2cnc3ccccc32)c1Cl
InChIInChI=1S/C13H8Cl2N2/c14-9-4-3-7-12(13(9)15)17-8-16-10-5-1-2-6-11(10)17/h1-8H
InChIKeyPAVPVHMLDZWBOX-UHFFFAOYSA-N
MW263.13 g/mol
LogP4.33
Rot. Bonds1

About 1-(2,3-dichlorophenyl)benzimidazole

1-(2,3-dichlorophenyl)benzimidazole (PubChem CID 42636654) has the molecular formula C13H8Cl2N2 and a molecular weight of 263.13 g/mol. Its IUPAC name is 1-(2,3-dichlorophenyl)benzimidazole.

Molecular Properties

Compound Name1-(2,3-dichlorophenyl)benzimidazole
PubChem CID42636654
Molecular FormulaC13H8Cl2N2
Molecular Weight263.13 g/mol
Exact Mass262.01
IUPAC Name1-(2,3-dichlorophenyl)benzimidazole
SMILESClc1cccc(-n2cnc3ccccc32)c1Cl
InChIInChI=1S/C13H8Cl2N2/c14-9-4-3-7-12(13(9)15)17-8-16-10-5-1-2-6-11(10)17/h1-8H
InChIKeyPAVPVHMLDZWBOX-UHFFFAOYSA-N
XLogP4.33
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.13
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dichlorophenyl)benzimidazole?
The IUPAC name of 1-(2,3-dichlorophenyl)benzimidazole (CID 42636654) is 1-(2,3-dichlorophenyl)benzimidazole.
What is the SMILES notation for 1-(2,3-dichlorophenyl)benzimidazole?
The canonical SMILES for 1-(2,3-dichlorophenyl)benzimidazole is Clc1cccc(-n2cnc3ccccc32)c1Cl.
What is the InChIKey of 1-(2,3-dichlorophenyl)benzimidazole?
The InChIKey is PAVPVHMLDZWBOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Cl2N2/c14-9-4-3-7-12(13(9)15)17-8-16-10-5-1-2-6-11(10)17/h1-8H.
What are the key properties of 1-(2,3-dichlorophenyl)benzimidazole?
1-(2,3-dichlorophenyl)benzimidazole has a molecular weight of 263.13 g/mol, XLogP of 4.33, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dichlorophenyl)benzimidazole is sourced from PubChem (CID 42636654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).