9-ethyl-2-(1-phenylbenzimidazol-2-yl)carbazole

C27H21N3 — CID 59346192

IUPAC9-ethyl-2-(1-phenylbenzimidazol-2-yl)carbazole
SMILESCCn1c2ccccc2c2ccc(-c3nc4ccccc4n3-c3ccccc3)cc21
InChIInChI=1S/C27H21N3/c1-2-29-24-14-8-6-12-21(24)22-17-16-19(18-26(22)29)27-28-23-13-7-9-15-25(23)30(27)20-10-4-3-5-11-20/h3-18H,2H2,1H3
InChIKeyXOUAGECFVBUDBT-UHFFFAOYSA-N
MW387.49 g/mol
LogP6.82
Rot. Bonds3

About 9-ethyl-2-(1-phenylbenzimidazol-2-yl)carbazole

9-ethyl-2-(1-phenylbenzimidazol-2-yl)carbazole (PubChem CID 59346192) has the molecular formula C27H21N3 and a molecular weight of 387.49 g/mol. Its IUPAC name is 9-ethyl-2-(1-phenylbenzimidazol-2-yl)carbazole.

Molecular Properties

Compound Name9-ethyl-2-(1-phenylbenzimidazol-2-yl)carbazole
PubChem CID59346192
Molecular FormulaC27H21N3
Molecular Weight387.49 g/mol
Exact Mass387.17
IUPAC Name9-ethyl-2-(1-phenylbenzimidazol-2-yl)carbazole
SMILESCCn1c2ccccc2c2ccc(-c3nc4ccccc4n3-c3ccccc3)cc21
InChIInChI=1S/C27H21N3/c1-2-29-24-14-8-6-12-21(24)22-17-16-19(18-26(22)29)27-28-23-13-7-9-15-25(23)30(27)20-10-4-3-5-11-20/h3-18H,2H2,1H3
InChIKeyXOUAGECFVBUDBT-UHFFFAOYSA-N
XLogP6.82
TPSA22.75 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.49
LogP ≤ 56.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-ethyl-3,6-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazole
CID 132521570
9-phenyl-3-[7-(1-phenylbenzimidazol-2-yl)triphenylen-2-yl]carbazole
CID 169294130
1-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]benzimidazole
CID 18629889
9-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 58470934
2-benzo[c]phenanthren-2-yl-1-phenylbenzimidazole
CID 58526346
1,2-diphenylbenzimidazole;ethane;iridium;propane
CID 142394497
N,9-diphenyl-N-[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazol-3-amine
CID 59500875
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
2-carbazol-9-yl-9-[3-(1-phenylbenzimidazol-2-yl)phenyl]carbazole
CID 144777561
2-[4-(1-methylnaphthalen-2-yl)phenyl]-1-phenylbenzimidazole
CID 135245229
2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-1-phenylbenzimidazole
CID 20771538

Frequently Asked Questions

What is the IUPAC name of 9-ethyl-2-(1-phenylbenzimidazol-2-yl)carbazole?
The IUPAC name of 9-ethyl-2-(1-phenylbenzimidazol-2-yl)carbazole (CID 59346192) is 9-ethyl-2-(1-phenylbenzimidazol-2-yl)carbazole.
What is the SMILES notation for 9-ethyl-2-(1-phenylbenzimidazol-2-yl)carbazole?
The canonical SMILES for 9-ethyl-2-(1-phenylbenzimidazol-2-yl)carbazole is CCn1c2ccccc2c2ccc(-c3nc4ccccc4n3-c3ccccc3)cc21.
What is the InChIKey of 9-ethyl-2-(1-phenylbenzimidazol-2-yl)carbazole?
The InChIKey is XOUAGECFVBUDBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H21N3/c1-2-29-24-14-8-6-12-21(24)22-17-16-19(18-26(22)29)27-28-23-13-7-9-15-25(23)30(27)20-10-4-3-5-11-20/h3-18H,2H2,1H3.
What are the key properties of 9-ethyl-2-(1-phenylbenzimidazol-2-yl)carbazole?
9-ethyl-2-(1-phenylbenzimidazol-2-yl)carbazole has a molecular weight of 387.49 g/mol, XLogP of 6.82, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-2-(1-phenylbenzimidazol-2-yl)carbazole is sourced from PubChem (CID 59346192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).