12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]carbazole

C42H27N3 — CID 130417453

IUPAC12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]carbazole
SMILESc1ccc(-n2c3ccccc3c3cccc(-n4c5ccccc5c5c4ccc4c6ccccc6n(-c6ccccc6)c45)c32)cc1
InChIInChI=1S/C42H27N3/c1-3-14-28(15-4-1)43-35-22-10-7-18-30(35)32-21-13-25-39(41(32)43)45-37-24-12-9-20-34(37)40-38(45)27-26-33-31-19-8-11-23-36(31)44(42(33)40)29-16-5-2-6-17-29/h1-27H
InChIKeyHLMCRDWQRPHTML-UHFFFAOYSA-N
MW573.70 g/mol
LogP10.98
Rot. Bonds3

About 12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]carbazole

12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]carbazole (PubChem CID 130417453) has the molecular formula C42H27N3 and a molecular weight of 573.70 g/mol. Its IUPAC name is 12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]carbazole.

Molecular Properties

Compound Name12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]carbazole
PubChem CID130417453
Molecular FormulaC42H27N3
Molecular Weight573.70 g/mol
Exact Mass573.22
IUPAC Name12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]carbazole
SMILESc1ccc(-n2c3ccccc3c3cccc(-n4c5ccccc5c5c4ccc4c6ccccc6n(-c6ccccc6)c45)c32)cc1
InChIInChI=1S/C42H27N3/c1-3-14-28(15-4-1)43-35-22-10-7-18-30(35)32-21-13-25-39(41(32)43)45-37-24-12-9-20-34(37)40-38(45)27-26-33-31-19-8-11-23-36(31)44(42(33)40)29-16-5-2-6-17-29/h1-27H
InChIKeyHLMCRDWQRPHTML-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

1-carbazol-9-yl-9-[9-(9-phenylcarbazol-1-yl)carbazol-4-yl]carbazole
CID 177094947
1-(4-carbazol-9-ylcarbazol-9-yl)-9-(9-phenylcarbazol-1-yl)carbazole
CID 177094929
5,12-diphenylindolo[3,2-c]carbazole
CID 22105108
5-phenyl-12-[4-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[3,2-c]carbazole
CID 134240235
5-[9-(9-phenylcarbazol-4-yl)carbazol-4-yl]-12-(3-phenylphenyl)indolo[3,2-c]carbazole
CID 170268286
5-[3-[11-(3-carbazol-9-ylphenyl)indolo[2,3-a]carbazol-12-yl]-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-12-phenylindolo[3,2-c]carbazole
CID 88917462
12,18-diphenyl-15-(9-phenylcarbazol-4-yl)-12,15,18-triazaheptacyclo[14.11.0.02,14.05,13.06,11.017,25.019,24]heptacosa-1(16),2(14),3,5(13),6,8,10,17(25),19,21,23,26-dodecaene
CID 174349441
5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole
CID 134597913
5-phenyl-11-[3-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]indolo[3,2-b]carbazole
CID 58038298
5-(3-carbazol-9-ylphenyl)-11-[3-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]indolo[3,2-b]carbazole
CID 88917500
12-(2-bromophenyl)-5-phenylindolo[3,2-c]carbazole
CID 126652646
11-phenyl-12-[9-(9-phenylcarbazol-4-yl)carbazol-3-yl]indolo[2,3-a]carbazole
CID 170268295

Frequently Asked Questions

What is the IUPAC name of 12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]carbazole?
The IUPAC name of 12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]carbazole (CID 130417453) is 12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]carbazole.
What is the SMILES notation for 12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]carbazole?
The canonical SMILES for 12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]carbazole is c1ccc(-n2c3ccccc3c3cccc(-n4c5ccccc5c5c4ccc4c6ccccc6n(-c6ccccc6)c45)c32)cc1.
What is the InChIKey of 12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]carbazole?
The InChIKey is HLMCRDWQRPHTML-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H27N3/c1-3-14-28(15-4-1)43-35-22-10-7-18-30(35)32-21-13-25-39(41(32)43)45-37-24-12-9-20-34(37)40-38(45)27-26-33-31-19-8-11-23-36(31)44(42(33)40)29-16-5-2-6-17-29/h1-27H.
What are the key properties of 12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]carbazole?
12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]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 12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]carbazole is sourced from PubChem (CID 130417453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).