8-ethyl-11,11-diphenylindolo[1,2-a]benzimidazole

C28H22N2 — CID 163617184

IUPAC8-ethyl-11,11-diphenylindolo[1,2-a]benzimidazole
SMILESCCc1ccc2c(c1)nc1n2-c2ccccc2C1(c1ccccc1)c1ccccc1
InChIInChI=1S/C28H22N2/c1-2-20-17-18-26-24(19-20)29-27-28(21-11-5-3-6-12-21,22-13-7-4-8-14-22)23-15-9-10-16-25(23)30(26)27/h3-19H,2H2,1H3
InChIKeySDJBJWRQKZFRRO-UHFFFAOYSA-N
MW386.50 g/mol
LogP6.28
Rot. Bonds3

About 8-ethyl-11,11-diphenylindolo[1,2-a]benzimidazole

8-ethyl-11,11-diphenylindolo[1,2-a]benzimidazole (PubChem CID 163617184) has the molecular formula C28H22N2 and a molecular weight of 386.50 g/mol. Its IUPAC name is 8-ethyl-11,11-diphenylindolo[1,2-a]benzimidazole.

Molecular Properties

Compound Name8-ethyl-11,11-diphenylindolo[1,2-a]benzimidazole
PubChem CID163617184
Molecular FormulaC28H22N2
Molecular Weight386.50 g/mol
Exact Mass386.18
IUPAC Name8-ethyl-11,11-diphenylindolo[1,2-a]benzimidazole
SMILESCCc1ccc2c(c1)nc1n2-c2ccccc2C1(c1ccccc1)c1ccccc1
InChIInChI=1S/C28H22N2/c1-2-20-17-18-26-24(19-20)29-27-28(21-11-5-3-6-12-21,22-13-7-4-8-14-22)23-15-9-10-16-25(23)30(26)27/h3-19H,2H2,1H3
InChIKeySDJBJWRQKZFRRO-UHFFFAOYSA-N
XLogP6.28
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.50
LogP ≤ 56.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

8-[4-[4-[(3E,5Z)-hepta-1,3,5-trien-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-11,11-diphenylindolo[1,2-a]benzimidazole
CID 142607132
2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]
CID 142606984
8'-[10-(1-phenylbenzimidazol-2-yl)anthracen-9-yl]spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]
CID 142607174
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-(4-phenylphenyl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]-1'-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]-1'-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]-8'-amine
CID 163614640
8'-bromospiro[1,2-dihydrofluorene-9,11'-indolo[1,2-a]benzimidazole]
CID 142607286
9-(4-ethylphenyl)-9-phenylfluorene
CID 149284542
8'-(4-phenylphenanthro[9,10-d]pyrimidin-2-yl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]
CID 142606981
2-[4-(4-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-dimethylindolo[1,2-a]benzimidazole;8-[4-(4-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-dimethylindolo[1,2-a]benzimidazole;8-[4-(4-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-diphenylindolo[1,2-a]benzimidazole;11,11-dimethyl-9-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[1,2-a]benzimidazole
CID 163783258
10-[6-(9,9-diphenylacridin-10-yl)-9-ethylcarbazol-3-yl]-9,9-diphenylacridine
CID 59470098
2-(7-phenylindolo[2,3-b]carbazol-5-yl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]
CID 142606955
5-[6-(13,13-diphenyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-5-yl)-2-phenylpyrimidin-4-yl]-13,13-diphenyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene
CID 88855571
4-(2,6-diphenylpyrimidin-4-yl)-11,11-diphenylindolo[1,2-a]benzimidazole
CID 162484029

Frequently Asked Questions

What is the IUPAC name of 8-ethyl-11,11-diphenylindolo[1,2-a]benzimidazole?
The IUPAC name of 8-ethyl-11,11-diphenylindolo[1,2-a]benzimidazole (CID 163617184) is 8-ethyl-11,11-diphenylindolo[1,2-a]benzimidazole.
What is the SMILES notation for 8-ethyl-11,11-diphenylindolo[1,2-a]benzimidazole?
The canonical SMILES for 8-ethyl-11,11-diphenylindolo[1,2-a]benzimidazole is CCc1ccc2c(c1)nc1n2-c2ccccc2C1(c1ccccc1)c1ccccc1.
What is the InChIKey of 8-ethyl-11,11-diphenylindolo[1,2-a]benzimidazole?
The InChIKey is SDJBJWRQKZFRRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H22N2/c1-2-20-17-18-26-24(19-20)29-27-28(21-11-5-3-6-12-21,22-13-7-4-8-14-22)23-15-9-10-16-25(23)30(26)27/h3-19H,2H2,1H3.
What are the key properties of 8-ethyl-11,11-diphenylindolo[1,2-a]benzimidazole?
8-ethyl-11,11-diphenylindolo[1,2-a]benzimidazole has a molecular weight of 386.50 g/mol, XLogP of 6.28, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-11,11-diphenylindolo[1,2-a]benzimidazole is sourced from PubChem (CID 163617184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).