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

C33H23N3 — CID 151226401

IUPAC9-[2-[1-(4-ethenylphenyl)benzimidazol-2-yl]phenyl]carbazole
SMILESC=Cc1ccc(-n2c(-c3ccccc3-n3c4ccccc4c4ccccc43)nc3ccccc32)cc1
InChIInChI=1S/C33H23N3/c1-2-23-19-21-24(22-20-23)35-32-18-10-6-14-28(32)34-33(35)27-13-5-9-17-31(27)36-29-15-7-3-11-25(29)26-12-4-8-16-30(26)36/h2-22H,1H2
InChIKeyNNJBPNHQFIRQAX-UHFFFAOYSA-N
MW461.57 g/mol
LogP8.43
Rot. Bonds4

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

9-[2-[1-(4-ethenylphenyl)benzimidazol-2-yl]phenyl]carbazole (PubChem CID 151226401) has the molecular formula C33H23N3 and a molecular weight of 461.57 g/mol. Its IUPAC name is 9-[2-[1-(4-ethenylphenyl)benzimidazol-2-yl]phenyl]carbazole.

Molecular Properties

Compound Name9-[2-[1-(4-ethenylphenyl)benzimidazol-2-yl]phenyl]carbazole
PubChem CID151226401
Molecular FormulaC33H23N3
Molecular Weight461.57 g/mol
Exact Mass461.19
IUPAC Name9-[2-[1-(4-ethenylphenyl)benzimidazol-2-yl]phenyl]carbazole
SMILESC=Cc1ccc(-n2c(-c3ccccc3-n3c4ccccc4c4ccccc43)nc3ccccc32)cc1
InChIInChI=1S/C33H23N3/c1-2-23-19-21-24(22-20-23)35-32-18-10-6-14-28(32)34-33(35)27-13-5-9-17-31(27)36-29-15-7-3-11-25(29)26-12-4-8-16-30(26)36/h2-22H,1H2
InChIKeyNNJBPNHQFIRQAX-UHFFFAOYSA-N
XLogP8.43
TPSA22.75 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500461.57
LogP ≤ 58.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-phenyl-2-[4-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]naphthalen-1-yl]benzimidazole
CID 129257071
9-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 58470934
lithium 2-(1-phenylbenzimidazol-2-yl)phenolate
CID 118618865
1-phenyl-2-(2-phenylphenyl)benzimidazole
CID 139044287
2-(3-ethenylphenyl)-1-phenylbenzimidazole
CID 89265101
1-phenyl-2-(1-phenylbenzimidazol-2-yl)benzimidazole
CID 44622931
9-[2-(4,6-diphenyl-2-pyridinyl)-4-(1-phenylbenzimidazol-2-yl)phenyl]carbazole
CID 163531483
(4-carbazol-9-ylphenyl)-(4-ethenylphenyl)-dimethylsilane
CID 59489115
11-phenyl-12-[4-(2-phenylbenzimidazol-1-yl)phenyl]indolo[2,3-a]carbazole
CID 90324561
9-[4-[3,5-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole
CID 58500868
11,12-diphenyl-5-(1-phenylbenzimidazol-2-yl)indolo[2,3-a]carbazole
CID 163519466
9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[1-(3-phenylphenyl)benzimidazol-2-yl]phenyl]carbazole
CID 148971314

Frequently Asked Questions

What is the IUPAC name of 9-[2-[1-(4-ethenylphenyl)benzimidazol-2-yl]phenyl]carbazole?
The IUPAC name of 9-[2-[1-(4-ethenylphenyl)benzimidazol-2-yl]phenyl]carbazole (CID 151226401) is 9-[2-[1-(4-ethenylphenyl)benzimidazol-2-yl]phenyl]carbazole.
What is the SMILES notation for 9-[2-[1-(4-ethenylphenyl)benzimidazol-2-yl]phenyl]carbazole?
The canonical SMILES for 9-[2-[1-(4-ethenylphenyl)benzimidazol-2-yl]phenyl]carbazole is C=Cc1ccc(-n2c(-c3ccccc3-n3c4ccccc4c4ccccc43)nc3ccccc32)cc1.
What is the InChIKey of 9-[2-[1-(4-ethenylphenyl)benzimidazol-2-yl]phenyl]carbazole?
The InChIKey is NNJBPNHQFIRQAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H23N3/c1-2-23-19-21-24(22-20-23)35-32-18-10-6-14-28(32)34-33(35)27-13-5-9-17-31(27)36-29-15-7-3-11-25(29)26-12-4-8-16-30(26)36/h2-22H,1H2.
What are the key properties of 9-[2-[1-(4-ethenylphenyl)benzimidazol-2-yl]phenyl]carbazole?
9-[2-[1-(4-ethenylphenyl)benzimidazol-2-yl]phenyl]carbazole has a molecular weight of 461.57 g/mol, XLogP of 8.43, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-[1-(4-ethenylphenyl)benzimidazol-2-yl]phenyl]carbazole is sourced from PubChem (CID 151226401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).