11-(9-phenylcarbazol-2-yl)-12-[3-(3-phenylphenyl)phenyl]indolo[2,3-a]carbazole

C54H35N3 — CID 134168610

IUPAC11-(9-phenylcarbazol-2-yl)-12-[3-(3-phenylphenyl)phenyl]indolo[2,3-a]carbazole
SMILESc1ccc(-c2cccc(-c3cccc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccc8c9ccccc9n(-c9ccccc9)c8c7)c6c54)c3)c2)cc1
InChIInChI=1S/C54H35N3/c1-3-15-36(16-4-1)37-17-13-18-38(33-37)39-19-14-22-41(34-39)56-50-27-11-8-24-44(50)47-31-32-48-45-25-9-12-28-51(45)57(54(48)53(47)56)42-29-30-46-43-23-7-10-26-49(43)55(52(46)35-42)40-20-5-2-6-21-40/h1-35H
InChIKeyLZOMTPDHNMBRDM-UHFFFAOYSA-N
MW725.90 g/mol
LogP14.31
Rot. Bonds5

About 11-(9-phenylcarbazol-2-yl)-12-[3-(3-phenylphenyl)phenyl]indolo[2,3-a]carbazole

11-(9-phenylcarbazol-2-yl)-12-[3-(3-phenylphenyl)phenyl]indolo[2,3-a]carbazole (PubChem CID 134168610) has the molecular formula C54H35N3 and a molecular weight of 725.90 g/mol. Its IUPAC name is 11-(9-phenylcarbazol-2-yl)-12-[3-(3-phenylphenyl)phenyl]indolo[2,3-a]carbazole.

Molecular Properties

Compound Name11-(9-phenylcarbazol-2-yl)-12-[3-(3-phenylphenyl)phenyl]indolo[2,3-a]carbazole
PubChem CID134168610
Molecular FormulaC54H35N3
Molecular Weight725.90 g/mol
Exact Mass725.28
IUPAC Name11-(9-phenylcarbazol-2-yl)-12-[3-(3-phenylphenyl)phenyl]indolo[2,3-a]carbazole
SMILESc1ccc(-c2cccc(-c3cccc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccc8c9ccccc9n(-c9ccccc9)c8c7)c6c54)c3)c2)cc1
InChIInChI=1S/C54H35N3/c1-3-15-36(16-4-1)37-17-13-18-38(33-37)39-19-14-22-41(34-39)56-50-27-11-8-24-44(50)47-31-32-48-45-25-9-12-28-51(45)57(54(48)53(47)56)42-29-30-46-43-23-7-10-26-49(43)55(52(46)35-42)40-20-5-2-6-21-40/h1-35H
InChIKeyLZOMTPDHNMBRDM-UHFFFAOYSA-N
XLogP14.31
TPSA14.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500725.90
LogP ≤ 514.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

11-phenyl-12-[4-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]indolo[2,3-a]carbazole
CID 134168606
1-(2-carbazol-9-ylcarbazol-9-yl)-9-[3-(3-phenylphenyl)phenyl]carbazole
CID 170374776
2-[9-[4-(3,5-diphenylphenyl)phenyl]carbazol-2-yl]-9-(3-phenylphenyl)carbazole;2-[9-(3-phenylphenyl)carbazol-2-yl]-9-[4-(3-phenylphenyl)phenyl]carbazole
CID 165058453
11-phenyl-12-[9-(3-phenylphenyl)carbazol-1-yl]indolo[2,3-a]carbazole
CID 164800329
11-[3-(4-phenylphenyl)phenyl]-12-[3-[11-[3-(4-phenylphenyl)phenyl]indolo[2,3-a]carbazol-12-yl]phenyl]indolo[2,3-a]carbazole
CID 170394025
2-carbazol-9-yl-9-[9-[3-phenyl-5-(3-phenylphenyl)phenyl]carbazol-2-yl]carbazole
CID 170659751
2-[9-(4-phenylphenyl)carbazol-2-yl]-9-[3-(4-phenylphenyl)phenyl]carbazole
CID 155241336
2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-9-(3-phenylphenyl)carbazole
CID 174179540
4-(3-carbazol-9-ylphenyl)-N-[4-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline
CID 118901505
5-phenyl-12-[3-(3-phenylphenyl)phenyl]indolo[3,2-c]carbazole
CID 153011834
12-(4-carbazol-9-ylphenyl)-5-(3-phenylphenyl)indolo[3,2-c]carbazole
CID 134168741
9-phenyl-2-[3-[4-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]phenyl]-7-[9-(3-phenylphenyl)carbazol-3-yl]carbazole
CID 166922681

Frequently Asked Questions

What is the IUPAC name of 11-(9-phenylcarbazol-2-yl)-12-[3-(3-phenylphenyl)phenyl]indolo[2,3-a]carbazole?
The IUPAC name of 11-(9-phenylcarbazol-2-yl)-12-[3-(3-phenylphenyl)phenyl]indolo[2,3-a]carbazole (CID 134168610) is 11-(9-phenylcarbazol-2-yl)-12-[3-(3-phenylphenyl)phenyl]indolo[2,3-a]carbazole.
What is the SMILES notation for 11-(9-phenylcarbazol-2-yl)-12-[3-(3-phenylphenyl)phenyl]indolo[2,3-a]carbazole?
The canonical SMILES for 11-(9-phenylcarbazol-2-yl)-12-[3-(3-phenylphenyl)phenyl]indolo[2,3-a]carbazole is c1ccc(-c2cccc(-c3cccc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccc8c9ccccc9n(-c9ccccc9)c8c7)c6c54)c3)c2)cc1.
What is the InChIKey of 11-(9-phenylcarbazol-2-yl)-12-[3-(3-phenylphenyl)phenyl]indolo[2,3-a]carbazole?
The InChIKey is LZOMTPDHNMBRDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H35N3/c1-3-15-36(16-4-1)37-17-13-18-38(33-37)39-19-14-22-41(34-39)56-50-27-11-8-24-44(50)47-31-32-48-45-25-9-12-28-51(45)57(54(48)53(47)56)42-29-30-46-43-23-7-10-26-49(43)55(52(46)35-42)40-20-5-2-6-21-40/h1-35H.
What are the key properties of 11-(9-phenylcarbazol-2-yl)-12-[3-(3-phenylphenyl)phenyl]indolo[2,3-a]carbazole?
11-(9-phenylcarbazol-2-yl)-12-[3-(3-phenylphenyl)phenyl]indolo[2,3-a]carbazole has a molecular weight of 725.90 g/mol, XLogP of 14.31, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 11-(9-phenylcarbazol-2-yl)-12-[3-(3-phenylphenyl)phenyl]indolo[2,3-a]carbazole is sourced from PubChem (CID 134168610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).