2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole

C42H27N3 — CID 118504684

IUPAC2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole
SMILESc1ccc(-n2c3ccccc3c3cc4c5cc(-n6c7ccccc7c7ccccc76)ccc5n(-c5ccccc5)c4cc32)cc1
InChIInChI=1S/C42H27N3/c1-3-13-28(14-4-1)43-39-22-12-9-19-33(39)35-26-36-34-25-30(45-37-20-10-7-17-31(37)32-18-8-11-21-38(32)45)23-24-40(34)44(42(36)27-41(35)43)29-15-5-2-6-16-29/h1-27H
InChIKeyIKANMXBTHFZCCQ-UHFFFAOYSA-N
MW573.70 g/mol
LogP10.98
Rot. Bonds3

About 2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole

2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole (PubChem CID 118504684) has the molecular formula C42H27N3 and a molecular weight of 573.70 g/mol. Its IUPAC name is 2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole.

Molecular Properties

Compound Name2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole
PubChem CID118504684
Molecular FormulaC42H27N3
Molecular Weight573.70 g/mol
Exact Mass573.22
IUPAC Name2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole
SMILESc1ccc(-n2c3ccccc3c3cc4c5cc(-n6c7ccccc7c7ccccc76)ccc5n(-c5ccccc5)c4cc32)cc1
InChIInChI=1S/C42H27N3/c1-3-13-28(14-4-1)43-39-22-12-9-19-33(39)35-26-36-34-25-30(45-37-20-10-7-17-31(37)32-18-8-11-21-38(32)45)23-24-40(34)44(42(36)27-41(35)43)29-15-5-2-6-16-29/h1-27H
InChIKeyIKANMXBTHFZCCQ-UHFFFAOYSA-N
XLogP10.98
TPSA14.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500573.70
LogP ≤ 510.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-carbazol-9-yl-6-(3-carbazol-9-ylcarbazol-9-yl)-9-phenylcarbazole
CID 146337769
2-(3-carbazol-9-ylcarbazol-9-yl)-9-(9-phenylcarbazol-3-yl)carbazole
CID 121274440
3-carbazol-9-yl-9-phenylcarbazole;ethane
CID 145117169
2-carbazol-9-yl-5-phenyl-7-(3-phenylphenyl)indolo[2,3-b]carbazole
CID 134194417
3-carbazol-9-yl-9-(3-carbazol-9-ylphenyl)carbazole;3-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazole;3-carbazol-9-yl-9-(4-phenylphenyl)carbazole;5,7-diphenylindolo[2,3-b]carbazole
CID 159682410
5-(9-phenylcarbazol-3-yl)-7-(4-phenylphenyl)indolo[2,3-b]carbazole;7-phenyl-5-(9-phenylcarbazol-3-yl)indolo[2,3-b]carbazole;7-phenyl-5-[9-(3-phenylphenyl)carbazol-3-yl]indolo[2,3-b]carbazole
CID 158411261
3-(9-phenylcarbazol-3-yl)-9-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazole
CID 174179535
bis(3-carbazol-9-yl-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole);9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole
CID 159641883
5,7-di(triphenylen-2-yl)indolo[2,3-b]carbazole
CID 166009487
2-carbazol-9-yl-9-phenylcarbazole
CID 118335086
2-methyl-7-(4-methylphenyl)-5-phenylindolo[2,3-b]carbazole
CID 71140488
9-[3-carbazol-9-yl-5-[3,5-di(carbazol-9-yl)phenyl]phenyl]carbazole;3-carbazol-9-yl-9-phenylcarbazole
CID 163609508

Frequently Asked Questions

What is the IUPAC name of 2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole?
The IUPAC name of 2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole (CID 118504684) is 2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole.
What is the SMILES notation for 2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole?
The canonical SMILES for 2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole is c1ccc(-n2c3ccccc3c3cc4c5cc(-n6c7ccccc7c7ccccc76)ccc5n(-c5ccccc5)c4cc32)cc1.
What is the InChIKey of 2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole?
The InChIKey is IKANMXBTHFZCCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H27N3/c1-3-13-28(14-4-1)43-39-22-12-9-19-33(39)35-26-36-34-25-30(45-37-20-10-7-17-31(37)32-18-8-11-21-38(32)45)23-24-40(34)44(42(36)27-41(35)43)29-15-5-2-6-16-29/h1-27H.
What are the key properties of 2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole?
2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole has a molecular weight of 573.70 g/mol, XLogP of 10.98, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole is sourced from PubChem (CID 118504684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).