2-(9-chlorodibenzofuran-2-yl)-1-phenylbenzimidazole

C25H15ClN2O — CID 155477397

IUPAC2-(9-chlorodibenzofuran-2-yl)-1-phenylbenzimidazole
SMILESClc1cccc2oc3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3c12
InChIInChI=1S/C25H15ClN2O/c26-19-9-6-12-23-24(19)18-15-16(13-14-22(18)29-23)25-27-20-10-4-5-11-21(20)28(25)17-7-2-1-3-8-17/h1-15H
InChIKeyXRGHNYDJSCUVAZ-UHFFFAOYSA-N
MW394.86 g/mol
LogP7.25
Rot. Bonds2

About 2-(9-chlorodibenzofuran-2-yl)-1-phenylbenzimidazole

2-(9-chlorodibenzofuran-2-yl)-1-phenylbenzimidazole (PubChem CID 155477397) has the molecular formula C25H15ClN2O and a molecular weight of 394.86 g/mol. Its IUPAC name is 2-(9-chlorodibenzofuran-2-yl)-1-phenylbenzimidazole.

Molecular Properties

Compound Name2-(9-chlorodibenzofuran-2-yl)-1-phenylbenzimidazole
PubChem CID155477397
Molecular FormulaC25H15ClN2O
Molecular Weight394.86 g/mol
Exact Mass394.09
IUPAC Name2-(9-chlorodibenzofuran-2-yl)-1-phenylbenzimidazole
SMILESClc1cccc2oc3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3c12
InChIInChI=1S/C25H15ClN2O/c26-19-9-6-12-23-24(19)18-15-16(13-14-22(18)29-23)25-27-20-10-4-5-11-21(20)28(25)17-7-2-1-3-8-17/h1-15H
InChIKeyXRGHNYDJSCUVAZ-UHFFFAOYSA-N
XLogP7.25
TPSA30.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.86
LogP ≤ 57.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenyl-6-(1-phenylbenzimidazol-2-yl)carbazole
CID 129292117
2-(7-phenyldibenzofuran-2-yl)-1-(3-phenylphenyl)benzimidazole
CID 157379685
2-[3-[4-dibenzofuran-3-yl-6-(3-triphenylen-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole
CID 171812807
14-[3-(1-phenylbenzimidazol-2-yl)phenyl]-9-oxa-15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene
CID 129122380
9-(4-dibenzofuran-2-ylphenyl)-3-[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazole
CID 118149535
2-[9-(4-dibenzothiophen-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-1-phenylbenzimidazole
CID 147448263
1-dibenzofuran-2-yl-2-[3-(1-dibenzofuran-2-ylbenzimidazol-2-yl)phenyl]benzimidazole
CID 58037471
N-dibenzofuran-3-yl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N,N-bis[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-phenyl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 161463384
1-dibenzofuran-2-yl-2-phenylbenzimidazole
CID 58401031
2-[9-[4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-1-phenylbenzimidazole
CID 148942600
2-[9-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-1-phenylbenzimidazole
CID 146917038
8-(1-phenylbenzimidazol-2-yl)-4-[4-[8-(1-phenylbenzimidazol-2-yl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine
CID 142336592

Frequently Asked Questions

What is the IUPAC name of 2-(9-chlorodibenzofuran-2-yl)-1-phenylbenzimidazole?
The IUPAC name of 2-(9-chlorodibenzofuran-2-yl)-1-phenylbenzimidazole (CID 155477397) is 2-(9-chlorodibenzofuran-2-yl)-1-phenylbenzimidazole.
What is the SMILES notation for 2-(9-chlorodibenzofuran-2-yl)-1-phenylbenzimidazole?
The canonical SMILES for 2-(9-chlorodibenzofuran-2-yl)-1-phenylbenzimidazole is Clc1cccc2oc3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3c12.
What is the InChIKey of 2-(9-chlorodibenzofuran-2-yl)-1-phenylbenzimidazole?
The InChIKey is XRGHNYDJSCUVAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H15ClN2O/c26-19-9-6-12-23-24(19)18-15-16(13-14-22(18)29-23)25-27-20-10-4-5-11-21(20)28(25)17-7-2-1-3-8-17/h1-15H.
What are the key properties of 2-(9-chlorodibenzofuran-2-yl)-1-phenylbenzimidazole?
2-(9-chlorodibenzofuran-2-yl)-1-phenylbenzimidazole has a molecular weight of 394.86 g/mol, XLogP of 7.25, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9-chlorodibenzofuran-2-yl)-1-phenylbenzimidazole is sourced from PubChem (CID 155477397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).