1H-benzimidazole;1,2-diphenylbenzene

C25H20N2 — CID 174973053

IUPAC1H-benzimidazole;1,2-diphenylbenzene
SMILESc1ccc(-c2ccccc2-c2ccccc2)cc1.c1ccc2[nH]cnc2c1
InChIInChI=1S/C18H14.C7H6N2/c1-3-9-15(10-4-1)17-13-7-8-14-18(17)16-11-5-2-6-12-16;1-2-4-7-6(3-1)8-5-9-7/h1-14H;1-5H,(H,8,9)
InChIKeyMUOQHSTYONYJQQ-UHFFFAOYSA-N
MW348.45 g/mol
LogP6.58
Rot. Bonds2

About 1H-benzimidazole;1,2-diphenylbenzene

1H-benzimidazole;1,2-diphenylbenzene (PubChem CID 174973053) has the molecular formula C25H20N2 and a molecular weight of 348.45 g/mol. Its IUPAC name is 1H-benzimidazole;1,2-diphenylbenzene.

Molecular Properties

Compound Name1H-benzimidazole;1,2-diphenylbenzene
PubChem CID174973053
Molecular FormulaC25H20N2
Molecular Weight348.45 g/mol
Exact Mass348.16
IUPAC Name1H-benzimidazole;1,2-diphenylbenzene
SMILESc1ccc(-c2ccccc2-c2ccccc2)cc1.c1ccc2[nH]cnc2c1
InChIInChI=1S/C18H14.C7H6N2/c1-3-9-15(10-4-1)17-13-7-8-14-18(17)16-11-5-2-6-12-16;1-2-4-7-6(3-1)8-5-9-7/h1-14H;1-5H,(H,8,9)
InChIKeyMUOQHSTYONYJQQ-UHFFFAOYSA-N
XLogP6.58
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.45
LogP ≤ 56.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1H-benzimidazole;1,2-diphenylbenzene?
The IUPAC name of 1H-benzimidazole;1,2-diphenylbenzene (CID 174973053) is 1H-benzimidazole;1,2-diphenylbenzene.
What is the SMILES notation for 1H-benzimidazole;1,2-diphenylbenzene?
The canonical SMILES for 1H-benzimidazole;1,2-diphenylbenzene is c1ccc(-c2ccccc2-c2ccccc2)cc1.c1ccc2[nH]cnc2c1.
What is the InChIKey of 1H-benzimidazole;1,2-diphenylbenzene?
The InChIKey is MUOQHSTYONYJQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14.C7H6N2/c1-3-9-15(10-4-1)17-13-7-8-14-18(17)16-11-5-2-6-12-16;1-2-4-7-6(3-1)8-5-9-7/h1-14H;1-5H,(H,8,9).
What are the key properties of 1H-benzimidazole;1,2-diphenylbenzene?
1H-benzimidazole;1,2-diphenylbenzene has a molecular weight of 348.45 g/mol, XLogP of 6.58, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-benzimidazole;1,2-diphenylbenzene is sourced from PubChem (CID 174973053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).