12-(4-bromophenyl)-11H-indolo[2,3-a]carbazole

C24H15BrN2 — CID 135315039

IUPAC12-(4-bromophenyl)-11H-indolo[2,3-a]carbazole
SMILESBrc1ccc(-n2c3ccccc3c3ccc4c5ccccc5[nH]c4c32)cc1
InChIInChI=1S/C24H15BrN2/c25-15-9-11-16(12-10-15)27-22-8-4-2-6-18(22)20-14-13-19-17-5-1-3-7-21(17)26-23(19)24(20)27/h1-14,26H
InChIKeyDFWNIYQRSRXRAK-UHFFFAOYSA-N
MW411.30 g/mol
LogP7.18
Rot. Bonds1

About 12-(4-bromophenyl)-11H-indolo[2,3-a]carbazole

12-(4-bromophenyl)-11H-indolo[2,3-a]carbazole (PubChem CID 135315039) has the molecular formula C24H15BrN2 and a molecular weight of 411.30 g/mol. Its IUPAC name is 12-(4-bromophenyl)-11H-indolo[2,3-a]carbazole.

Molecular Properties

Compound Name12-(4-bromophenyl)-11H-indolo[2,3-a]carbazole
PubChem CID135315039
Molecular FormulaC24H15BrN2
Molecular Weight411.30 g/mol
Exact Mass410.04
IUPAC Name12-(4-bromophenyl)-11H-indolo[2,3-a]carbazole
SMILESBrc1ccc(-n2c3ccccc3c3ccc4c5ccccc5[nH]c4c32)cc1
InChIInChI=1S/C24H15BrN2/c25-15-9-11-16(12-10-15)27-22-8-4-2-6-18(22)20-14-13-19-17-5-1-3-7-21(17)26-23(19)24(20)27/h1-14,26H
InChIKeyDFWNIYQRSRXRAK-UHFFFAOYSA-N
XLogP7.18
TPSA20.72 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500411.30
LogP ≤ 57.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

12-[4-(3-phenylphenyl)phenyl]-11H-indolo[2,3-a]carbazole
CID 165165620
(4-bromophenyl)-diphenylborane;diphenyl-[4-(1-phenylpyrrolo[2,3-a]carbazol-10-yl)phenyl]borane;1-phenyl-10H-pyrrolo[2,3-a]carbazole
CID 161358553
12-[4-(4-carbazol-9-ylphenyl)-6-(11H-indolo[2,3-a]carbazol-12-yl)-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole
CID 88887877
3-(4-bromophenyl)pyridine;1-phenyl-10-(4-pyridin-3-ylphenyl)pyrrolo[2,3-a]carbazole;1-phenyl-10H-pyrrolo[2,3-a]carbazole
CID 161092748
12-[9-(9-phenylcarbazol-3-yl)carbazol-4-yl]-11H-indolo[2,3-a]carbazole
CID 170424202
12-[2-(2-phenylphenyl)phenyl]-11H-indolo[2,3-a]carbazole
CID 165165529
12-tert-butyl-11H-indolo[2,3-a]carbazole
CID 172511802
11,12-bis(4-carbazol-9-ylphenyl)indolo[2,3-a]carbazole
CID 70938031
12-[4-(4-carbazol-9-yl-2-phenylphenyl)-6-(11H-indolo[2,3-a]carbazol-12-yl)-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole
CID 123785802
12-(4-bromophenyl)-[1]benzofuro[2,3-a]carbazole
CID 129291278
4-tert-butyl-N-(4-carbazol-9-ylphenyl)-N-[4-(12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaen-12-yl)phenyl]aniline
CID 66585153
2-[2-(11H-indolo[2,3-a]carbazol-12-yl)phenyl]benzene-1,3-dicarbonitrile
CID 122433826

Frequently Asked Questions

What is the IUPAC name of 12-(4-bromophenyl)-11H-indolo[2,3-a]carbazole?
The IUPAC name of 12-(4-bromophenyl)-11H-indolo[2,3-a]carbazole (CID 135315039) is 12-(4-bromophenyl)-11H-indolo[2,3-a]carbazole.
What is the SMILES notation for 12-(4-bromophenyl)-11H-indolo[2,3-a]carbazole?
The canonical SMILES for 12-(4-bromophenyl)-11H-indolo[2,3-a]carbazole is Brc1ccc(-n2c3ccccc3c3ccc4c5ccccc5[nH]c4c32)cc1.
What is the InChIKey of 12-(4-bromophenyl)-11H-indolo[2,3-a]carbazole?
The InChIKey is DFWNIYQRSRXRAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15BrN2/c25-15-9-11-16(12-10-15)27-22-8-4-2-6-18(22)20-14-13-19-17-5-1-3-7-21(17)26-23(19)24(20)27/h1-14,26H.
What are the key properties of 12-(4-bromophenyl)-11H-indolo[2,3-a]carbazole?
12-(4-bromophenyl)-11H-indolo[2,3-a]carbazole has a molecular weight of 411.30 g/mol, XLogP of 7.18, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 12-(4-bromophenyl)-11H-indolo[2,3-a]carbazole is sourced from PubChem (CID 135315039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).