2-[2-(1,6-dichloronaphthalen-2-yl)phenyl]-1H-benzimidazole

C23H14Cl2N2 — CID 134336865

IUPAC2-[2-(1,6-dichloronaphthalen-2-yl)phenyl]-1H-benzimidazole
SMILESClc1ccc2c(Cl)c(-c3ccccc3-c3nc4ccccc4[nH]3)ccc2c1
InChIInChI=1S/C23H14Cl2N2/c24-15-10-12-16-14(13-15)9-11-18(22(16)25)17-5-1-2-6-19(17)23-26-20-7-3-4-8-21(20)27-23/h1-13H,(H,26,27)
InChIKeyLISIYWFXWZEUJC-UHFFFAOYSA-N
MW389.29 g/mol
LogP7.36
Rot. Bonds2

About 2-[2-(1,6-dichloronaphthalen-2-yl)phenyl]-1H-benzimidazole

2-[2-(1,6-dichloronaphthalen-2-yl)phenyl]-1H-benzimidazole (PubChem CID 134336865) has the molecular formula C23H14Cl2N2 and a molecular weight of 389.29 g/mol. Its IUPAC name is 2-[2-(1,6-dichloronaphthalen-2-yl)phenyl]-1H-benzimidazole.

Molecular Properties

Compound Name2-[2-(1,6-dichloronaphthalen-2-yl)phenyl]-1H-benzimidazole
PubChem CID134336865
Molecular FormulaC23H14Cl2N2
Molecular Weight389.29 g/mol
Exact Mass388.05
IUPAC Name2-[2-(1,6-dichloronaphthalen-2-yl)phenyl]-1H-benzimidazole
SMILESClc1ccc2c(Cl)c(-c3ccccc3-c3nc4ccccc4[nH]3)ccc2c1
InChIInChI=1S/C23H14Cl2N2/c24-15-10-12-16-14(13-15)9-11-18(22(16)25)17-5-1-2-6-19(17)23-26-20-7-3-4-8-21(20)27-23/h1-13H,(H,26,27)
InChIKeyLISIYWFXWZEUJC-UHFFFAOYSA-N
XLogP7.36
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.29
LogP ≤ 57.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[2-(2,3-dichlorophenyl)phenyl]-1H-benzimidazole
CID 134336861
2-[3-chloro-2-(1-chloronaphthalen-2-yl)phenyl]-1H-benzimidazole
CID 134336885
3-(1H-benzimidazol-2-yl)-2-(2,4-dichlorophenyl)quinoline
CID 71230104
2-phenanthren-9-yl-1H-benzimidazole
CID 102492769
2-(2,5-difluorophenyl)-1H-benzimidazole
CID 43348986
2-(2-chloro-4-phenylphenyl)-1H-benzimidazole
CID 168554361
6-chloro-2-(2,4-dichlorophenyl)-1H-benzimidazole
CID 60646513
2-(1-bromonaphthalen-2-yl)-1H-benzimidazole
CID 101479527
2-(4-chloro-2,5-dimethylphenyl)-1H-benzimidazole
CID 168554186
2-(1H-benzimidazol-2-yl)-6-fluorophenol
CID 168553450
2-(1H-benzimidazol-2-yl)-5-chloro-1,3-benzoxazole
CID 135692693
2-[2-(3-chloro-2-pyridinyl)phenyl]-1H-benzimidazole
CID 129162881

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1,6-dichloronaphthalen-2-yl)phenyl]-1H-benzimidazole?
The IUPAC name of 2-[2-(1,6-dichloronaphthalen-2-yl)phenyl]-1H-benzimidazole (CID 134336865) is 2-[2-(1,6-dichloronaphthalen-2-yl)phenyl]-1H-benzimidazole.
What is the SMILES notation for 2-[2-(1,6-dichloronaphthalen-2-yl)phenyl]-1H-benzimidazole?
The canonical SMILES for 2-[2-(1,6-dichloronaphthalen-2-yl)phenyl]-1H-benzimidazole is Clc1ccc2c(Cl)c(-c3ccccc3-c3nc4ccccc4[nH]3)ccc2c1.
What is the InChIKey of 2-[2-(1,6-dichloronaphthalen-2-yl)phenyl]-1H-benzimidazole?
The InChIKey is LISIYWFXWZEUJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H14Cl2N2/c24-15-10-12-16-14(13-15)9-11-18(22(16)25)17-5-1-2-6-19(17)23-26-20-7-3-4-8-21(20)27-23/h1-13H,(H,26,27).
What are the key properties of 2-[2-(1,6-dichloronaphthalen-2-yl)phenyl]-1H-benzimidazole?
2-[2-(1,6-dichloronaphthalen-2-yl)phenyl]-1H-benzimidazole has a molecular weight of 389.29 g/mol, XLogP of 7.36, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1,6-dichloronaphthalen-2-yl)phenyl]-1H-benzimidazole is sourced from PubChem (CID 134336865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).