1-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole;6-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole

C163H101N15 — CID 158646721

IUPAC1-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole;6-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5cc6ccccc6cc5c5c(-n6c7ccccc7c7ccc8ccccc8c76)cccc54)c4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc6ccccc6c(-n6c7ccccc7c7ccc8ccccc8c76)c54)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-n3c4ccc(-n5c6ccccc6c6ccc7ccccc7c65)cc4c4cc5ccccc5cc43)n2)cc1
InChIInChI=1S/C57H35N5.2C53H33N5/c1-3-17-37(18-4-1)55-58-56(38-19-5-2-6-20-38)60-57(59-55)46-32-33-49(43-25-12-11-24-42(43)46)61-50-28-15-29-51(53(50)47-34-39-21-7-8-22-40(39)35-52(47)61)62-48-27-14-13-26-44(48)45-31-30-36-16-9-10-23-41(36)54(45)62;1-3-16-35(17-4-1)51-54-52(36-18-5-2-6-19-36)56-53(55-51)37-27-30-39(31-28-37)57-46-25-13-12-24-43(46)45-33-38-20-8-10-22-41(38)49(50(45)57)58-47-26-14-11-23-42(47)44-32-29-34-15-7-9-21-40(34)48(44)58;1-3-16-35(17-4-1)51-54-52(36-18-5-2-6-19-36)56-53(55-51)43-24-12-14-26-47(43)58-48-30-28-39(33-45(48)44-31-37-20-7-8-21-38(37)32-49(44)58)57-46-25-13-11-23-41(46)42-29-27-34-15-9-10-22-40(34)50(42)57/h1-35H;2*1-33H
InChIKeyIBBCKDBVYWCVRP-UHFFFAOYSA-N
MW2269.71 g/mol
LogP41.27
Rot. Bonds15

About 1-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole;6-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole

1-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole;6-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole (PubChem CID 158646721) has the molecular formula C163H101N15 and a molecular weight of 2269.71 g/mol. Its IUPAC name is 1-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole;6-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole.

Molecular Properties

Compound Name1-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole;6-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole
PubChem CID158646721
Molecular FormulaC163H101N15
Molecular Weight2269.71 g/mol
Exact Mass2267.84
IUPAC Name1-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole;6-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5cc6ccccc6cc5c5c(-n6c7ccccc7c7ccc8ccccc8c76)cccc54)c4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc6ccccc6c(-n6c7ccccc7c7ccc8ccccc8c76)c54)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-n3c4ccc(-n5c6ccccc6c6ccc7ccccc7c65)cc4c4cc5ccccc5cc43)n2)cc1
InChIInChI=1S/C57H35N5.2C53H33N5/c1-3-17-37(18-4-1)55-58-56(38-19-5-2-6-20-38)60-57(59-55)46-32-33-49(43-25-12-11-24-42(43)46)61-50-28-15-29-51(53(50)47-34-39-21-7-8-22-40(39)35-52(47)61)62-48-27-14-13-26-44(48)45-31-30-36-16-9-10-23-41(36)54(45)62;1-3-16-35(17-4-1)51-54-52(36-18-5-2-6-19-36)56-53(55-51)37-27-30-39(31-28-37)57-46-25-13-12-24-43(46)45-33-38-20-8-10-22-41(38)49(50(45)57)58-47-26-14-11-23-42(47)44-32-29-34-15-7-9-21-40(34)48(44)58;1-3-16-35(17-4-1)51-54-52(36-18-5-2-6-19-36)56-53(55-51)43-24-12-14-26-47(43)58-48-30-28-39(33-45(48)44-31-37-20-7-8-21-38(37)32-49(44)58)57-46-25-13-11-23-41(46)42-29-27-34-15-9-10-22-40(34)50(42)57/h1-35H;2*1-33H
InChIKeyIBBCKDBVYWCVRP-UHFFFAOYSA-N
XLogP41.27
TPSA145.59 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds15
Heavy Atoms178
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002269.71
LogP ≤ 541.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 1-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole;6-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole;6-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole?
The IUPAC name of 1-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole;6-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole (CID 158646721) is 1-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole;6-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole.
What is the SMILES notation for 1-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole;6-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole?
The canonical SMILES for 1-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole;6-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole is c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5cc6ccccc6cc5c5c(-n6c7ccccc7c7ccc8ccccc8c76)cccc54)c4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc6ccccc6c(-n6c7ccccc7c7ccc8ccccc8c76)c54)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-n3c4ccc(-n5c6ccccc6c6ccc7ccccc7c65)cc4c4cc5ccccc5cc43)n2)cc1.
What is the InChIKey of 1-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole;6-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole?
The InChIKey is IBBCKDBVYWCVRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H35N5.2C53H33N5/c1-3-17-37(18-4-1)55-58-56(38-19-5-2-6-20-38)60-57(59-55)46-32-33-49(43-25-12-11-24-42(43)46)61-50-28-15-29-51(53(50)47-34-39-21-7-8-22-40(39)35-52(47)61)62-48-27-14-13-26-44(48)45-31-30-36-16-9-10-23-41(36)54(45)62;1-3-16-35(17-4-1)51-54-52(36-18-5-2-6-19-36)56-53(55-51)37-27-30-39(31-28-37)57-46-25-13-12-24-43(46)45-33-38-20-8-10-22-41(38)49(50(45)57)58-47-26-14-11-23-42(47)44-32-29-34-15-7-9-21-40(34)48(44)58;1-3-16-35(17-4-1)51-54-52(36-18-5-2-6-19-36)56-53(55-51)43-24-12-14-26-47(43)58-48-30-28-39(33-45(48)44-31-37-20-7-8-21-38(37)32-49(44)58)57-46-25-13-11-23-41(46)42-29-27-34-15-9-10-22-40(34)50(42)57/h1-35H;2*1-33H.
What are the key properties of 1-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole;6-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole?
1-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole;6-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole has a molecular weight of 2269.71 g/mol, XLogP of 41.27, 15 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole;6-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole is sourced from PubChem (CID 158646721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).