9-[2-[2-(2-chlorophenyl)phenyl]-1H-benzimidazol-4-yl]carbazole

C31H20ClN3 — CID 165092975

IUPAC9-[2-[2-(2-chlorophenyl)phenyl]-1H-benzimidazol-4-yl]carbazole
SMILESClc1ccccc1-c1ccccc1-c1nc2c(-n3c4ccccc4c4ccccc43)cccc2[nH]1
InChIInChI=1S/C31H20ClN3/c32-25-15-6-3-11-21(25)20-10-1-2-14-24(20)31-33-26-16-9-19-29(30(26)34-31)35-27-17-7-4-12-22(27)23-13-5-8-18-28(23)35/h1-19H,(H,33,34)
InChIKeyXAIDANFAHZNNGJ-UHFFFAOYSA-N
MW469.98 g/mol
LogP8.65
Rot. Bonds3

About 9-[2-[2-(2-chlorophenyl)phenyl]-1H-benzimidazol-4-yl]carbazole

9-[2-[2-(2-chlorophenyl)phenyl]-1H-benzimidazol-4-yl]carbazole (PubChem CID 165092975) has the molecular formula C31H20ClN3 and a molecular weight of 469.98 g/mol. Its IUPAC name is 9-[2-[2-(2-chlorophenyl)phenyl]-1H-benzimidazol-4-yl]carbazole.

Molecular Properties

Compound Name9-[2-[2-(2-chlorophenyl)phenyl]-1H-benzimidazol-4-yl]carbazole
PubChem CID165092975
Molecular FormulaC31H20ClN3
Molecular Weight469.98 g/mol
Exact Mass469.13
IUPAC Name9-[2-[2-(2-chlorophenyl)phenyl]-1H-benzimidazol-4-yl]carbazole
SMILESClc1ccccc1-c1ccccc1-c1nc2c(-n3c4ccccc4c4ccccc43)cccc2[nH]1
InChIInChI=1S/C31H20ClN3/c32-25-15-6-3-11-21(25)20-10-1-2-14-24(20)31-33-26-16-9-19-29(30(26)34-31)35-27-17-7-4-12-22(27)23-13-5-8-18-28(23)35/h1-19H,(H,33,34)
InChIKeyXAIDANFAHZNNGJ-UHFFFAOYSA-N
XLogP8.65
TPSA33.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500469.98
LogP ≤ 58.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

9-[2-(2-chlorophenyl)phenyl]-1-fluorocarbazole
CID 163919842
2-[2-(2,3-dichlorophenyl)phenyl]-1H-benzimidazole
CID 134336861
2-(2,3-dichlorophenyl)-4-fluoro-1H-benzimidazole
CID 60977717
9-[2-(2-chlorophenyl)-6-phenylphenyl]carbazole
CID 170664502
4-chloro-2-(2,5-dimethylphenyl)-1H-benzimidazole
CID 64723918
4-chloro-2-(2-chlorophenyl)-3H-imidazo[4,5-c]quinoline
CID 121005270
12-[2-(2-chlorophenyl)phenyl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 170664600
2-(3-chloro-2-fluorophenyl)-1H-benzimidazol-4-amine
CID 81267619
9-naphthalen-1-yl-1-(9-naphthalen-1-ylcarbazol-1-yl)carbazole
CID 134507274
12-[2-(2-phenylphenyl)phenyl]-11H-indolo[2,3-a]carbazole
CID 165165529
9-[2-[4-(2-carbazol-9-ylphenyl)-6-methyl-1,3,5-triazin-2-yl]phenyl]carbazole
CID 170940965
5-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole
CID 134603586

Frequently Asked Questions

What is the IUPAC name of 9-[2-[2-(2-chlorophenyl)phenyl]-1H-benzimidazol-4-yl]carbazole?
The IUPAC name of 9-[2-[2-(2-chlorophenyl)phenyl]-1H-benzimidazol-4-yl]carbazole (CID 165092975) is 9-[2-[2-(2-chlorophenyl)phenyl]-1H-benzimidazol-4-yl]carbazole.
What is the SMILES notation for 9-[2-[2-(2-chlorophenyl)phenyl]-1H-benzimidazol-4-yl]carbazole?
The canonical SMILES for 9-[2-[2-(2-chlorophenyl)phenyl]-1H-benzimidazol-4-yl]carbazole is Clc1ccccc1-c1ccccc1-c1nc2c(-n3c4ccccc4c4ccccc43)cccc2[nH]1.
What is the InChIKey of 9-[2-[2-(2-chlorophenyl)phenyl]-1H-benzimidazol-4-yl]carbazole?
The InChIKey is XAIDANFAHZNNGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H20ClN3/c32-25-15-6-3-11-21(25)20-10-1-2-14-24(20)31-33-26-16-9-19-29(30(26)34-31)35-27-17-7-4-12-22(27)23-13-5-8-18-28(23)35/h1-19H,(H,33,34).
What are the key properties of 9-[2-[2-(2-chlorophenyl)phenyl]-1H-benzimidazol-4-yl]carbazole?
9-[2-[2-(2-chlorophenyl)phenyl]-1H-benzimidazol-4-yl]carbazole has a molecular weight of 469.98 g/mol, XLogP of 8.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-[2-(2-chlorophenyl)phenyl]-1H-benzimidazol-4-yl]carbazole is sourced from PubChem (CID 165092975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).