11-benzo[c]carbazol-7-yl-5-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole

C63H39N5 — CID 155477635

IUPAC11-benzo[c]carbazol-7-yl-5-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole
SMILESc1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccc5cccc(-n6c7ccccc7c7c(-n8c9ccccc9c9c%10ccccc%10ccc98)c8ccccc8cc76)c5c4)n3)c2)cc1
InChIInChI=1S/C63H39N5/c1-3-17-40(18-4-1)44-24-15-25-46(37-44)62-64-61(43-20-5-2-6-21-43)65-63(66-62)47-34-33-42-23-16-32-55(52(42)38-47)67-53-30-13-12-29-51(53)59-57(67)39-45-22-8-10-27-49(45)60(59)68-54-31-14-11-28-50(54)58-48-26-9-7-19-41(48)35-36-56(58)68/h1-39H
InChIKeyOCOVURRTFXWWIO-UHFFFAOYSA-N
MW866.04 g/mol
LogP16.19
Rot. Bonds6

About 11-benzo[c]carbazol-7-yl-5-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole

11-benzo[c]carbazol-7-yl-5-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole (PubChem CID 155477635) has the molecular formula C63H39N5 and a molecular weight of 866.04 g/mol. Its IUPAC name is 11-benzo[c]carbazol-7-yl-5-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole.

Molecular Properties

Compound Name11-benzo[c]carbazol-7-yl-5-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole
PubChem CID155477635
Molecular FormulaC63H39N5
Molecular Weight866.04 g/mol
Exact Mass865.32
IUPAC Name11-benzo[c]carbazol-7-yl-5-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole
SMILESc1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccc5cccc(-n6c7ccccc7c7c(-n8c9ccccc9c9c%10ccccc%10ccc98)c8ccccc8cc76)c5c4)n3)c2)cc1
InChIInChI=1S/C63H39N5/c1-3-17-40(18-4-1)44-24-15-25-46(37-44)62-64-61(43-20-5-2-6-21-43)65-63(66-62)47-34-33-42-23-16-32-55(52(42)38-47)67-53-30-13-12-29-51(53)59-57(67)39-45-22-8-10-27-49(45)60(59)68-54-31-14-11-28-50(54)58-48-26-9-7-19-41(48)35-36-56(58)68/h1-39H
InChIKeyOCOVURRTFXWWIO-UHFFFAOYSA-N
XLogP16.19
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms68
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500866.04
LogP ≤ 516.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-carbazol-9-yl-5-[4-[4-[3-[9-[5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazol-11-yl]carbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]benzo[b]carbazole
CID 155477643
7-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[c]carbazole
CID 164781358
7-benzo[c]carbazol-7-yl-5-[6-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]benzo[b]carbazole
CID 155477625
7-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]-10-phenylbenzo[c]carbazole
CID 118133197
7-naphthalen-1-yl-2-phenylbenzo[c]carbazole
CID 130351033
7-[4-[3-[4-(4-naphthalen-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]benzo[c]carbazole
CID 166916612
7-[3-[4-(4-naphthalen-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[c]carbazole
CID 167031981
22-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-22-azahexacyclo[12.11.0.02,11.03,8.015,23.016,21]pentacosa-1(14),2(11),3,5,7,9,12,15(23),16,18,20,24-dodecaene
CID 154597974
11-carbazol-9-yl-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole
CID 155477254
2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylbenzo[c]carbazole
CID 130351139
7-[2-[4-[4-(4-naphthalen-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]benzo[c]carbazole
CID 167032390
7-[3-[4-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]phenyl]benzo[c]carbazole
CID 166915910

Frequently Asked Questions

What is the IUPAC name of 11-benzo[c]carbazol-7-yl-5-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole?
The IUPAC name of 11-benzo[c]carbazol-7-yl-5-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole (CID 155477635) is 11-benzo[c]carbazol-7-yl-5-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole.
What is the SMILES notation for 11-benzo[c]carbazol-7-yl-5-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole?
The canonical SMILES for 11-benzo[c]carbazol-7-yl-5-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole is c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccc5cccc(-n6c7ccccc7c7c(-n8c9ccccc9c9c%10ccccc%10ccc98)c8ccccc8cc76)c5c4)n3)c2)cc1.
What is the InChIKey of 11-benzo[c]carbazol-7-yl-5-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole?
The InChIKey is OCOVURRTFXWWIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H39N5/c1-3-17-40(18-4-1)44-24-15-25-46(37-44)62-64-61(43-20-5-2-6-21-43)65-63(66-62)47-34-33-42-23-16-32-55(52(42)38-47)67-53-30-13-12-29-51(53)59-57(67)39-45-22-8-10-27-49(45)60(59)68-54-31-14-11-28-50(54)58-48-26-9-7-19-41(48)35-36-56(58)68/h1-39H.
What are the key properties of 11-benzo[c]carbazol-7-yl-5-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole?
11-benzo[c]carbazol-7-yl-5-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole has a molecular weight of 866.04 g/mol, XLogP of 16.19, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 11-benzo[c]carbazol-7-yl-5-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole is sourced from PubChem (CID 155477635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).