9-[4-carbazol-9-yl-6-(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[3-carbazol-9-yl-5-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;9-[5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-pyridinyl]carbazole

C130H85N13 — CID 157422186

IUPAC9-[4-carbazol-9-yl-6-(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[3-carbazol-9-yl-5-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;9-[5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-pyridinyl]carbazole
SMILESc1ccc(-c2cc(-c3cc(-n4c5ccccc5c5ccccc54)cc(-n4c5ccccc5c5ccccc54)c3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-n4c5ccccc5c5ccccc54)nc(-n4c5ccccc5c5ccccc54)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)nc4)c3)n2)cc1
InChIInChI=1S/C47H31N3.C45H29N5.C38H25N5/c1-3-15-32(16-4-1)42-29-35(30-43(48-42)33-17-5-2-6-18-33)34-27-36(49-44-23-11-7-19-38(44)39-20-8-12-24-45(39)49)31-37(28-34)50-46-25-13-9-21-40(46)41-22-10-14-26-47(41)50;1-3-15-30(16-4-1)32-27-33(31-17-5-2-6-18-31)29-34(28-32)43-46-44(49-39-23-11-7-19-35(39)36-20-8-12-24-40(36)49)48-45(47-43)50-41-25-13-9-21-37(41)38-22-10-14-26-42(38)50;1-3-12-26(13-4-1)36-40-37(27-14-5-2-6-15-27)42-38(41-36)29-17-11-16-28(24-29)30-22-23-35(39-25-30)43-33-20-9-7-18-31(33)32-19-8-10-21-34(32)43/h1-31H;1-29H;1-25H
InChIKeyBPNRSYUDHWIQJG-UHFFFAOYSA-N
MW1829.20 g/mol
LogP32.38
Rot. Bonds15

About 9-[4-carbazol-9-yl-6-(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[3-carbazol-9-yl-5-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;9-[5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-pyridinyl]carbazole

9-[4-carbazol-9-yl-6-(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[3-carbazol-9-yl-5-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;9-[5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-pyridinyl]carbazole (PubChem CID 157422186) has the molecular formula C130H85N13 and a molecular weight of 1829.20 g/mol. Its IUPAC name is 9-[4-carbazol-9-yl-6-(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[3-carbazol-9-yl-5-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;9-[5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-pyridinyl]carbazole.

Molecular Properties

Compound Name9-[4-carbazol-9-yl-6-(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[3-carbazol-9-yl-5-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;9-[5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-pyridinyl]carbazole
PubChem CID157422186
Molecular FormulaC130H85N13
Molecular Weight1829.20 g/mol
Exact Mass1827.71
IUPAC Name9-[4-carbazol-9-yl-6-(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[3-carbazol-9-yl-5-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;9-[5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-pyridinyl]carbazole
SMILESc1ccc(-c2cc(-c3cc(-n4c5ccccc5c5ccccc54)cc(-n4c5ccccc5c5ccccc54)c3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-n4c5ccccc5c5ccccc54)nc(-n4c5ccccc5c5ccccc54)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)nc4)c3)n2)cc1
InChIInChI=1S/C47H31N3.C45H29N5.C38H25N5/c1-3-15-32(16-4-1)42-29-35(30-43(48-42)33-17-5-2-6-18-33)34-27-36(49-44-23-11-7-19-38(44)39-20-8-12-24-45(39)49)31-37(28-34)50-46-25-13-9-21-40(46)41-22-10-14-26-47(41)50;1-3-15-30(16-4-1)32-27-33(31-17-5-2-6-18-31)29-34(28-32)43-46-44(49-39-23-11-7-19-35(39)36-20-8-12-24-40(36)49)48-45(47-43)50-41-25-13-9-21-37(41)38-22-10-14-26-42(38)50;1-3-12-26(13-4-1)36-40-37(27-14-5-2-6-15-27)42-38(41-36)29-17-11-16-28(24-29)30-22-23-35(39-25-30)43-33-20-9-7-18-31(33)32-19-8-10-21-34(32)43/h1-31H;1-29H;1-25H
InChIKeyBPNRSYUDHWIQJG-UHFFFAOYSA-N
XLogP32.38
TPSA127.77 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds15
Heavy Atoms143
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001829.20
LogP ≤ 532.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Analyze 9-[4-carbazol-9-yl-6-(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[3-carbazol-9-yl-5-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;9-[5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-pyridinyl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-[4-carbazol-9-yl-6-(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[3-carbazol-9-yl-5-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;9-[5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-pyridinyl]carbazole?
The IUPAC name of 9-[4-carbazol-9-yl-6-(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[3-carbazol-9-yl-5-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;9-[5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-pyridinyl]carbazole (CID 157422186) is 9-[4-carbazol-9-yl-6-(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[3-carbazol-9-yl-5-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;9-[5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-pyridinyl]carbazole.
What is the SMILES notation for 9-[4-carbazol-9-yl-6-(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[3-carbazol-9-yl-5-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;9-[5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-pyridinyl]carbazole?
The canonical SMILES for 9-[4-carbazol-9-yl-6-(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[3-carbazol-9-yl-5-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;9-[5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-pyridinyl]carbazole is c1ccc(-c2cc(-c3cc(-n4c5ccccc5c5ccccc54)cc(-n4c5ccccc5c5ccccc54)c3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-n4c5ccccc5c5ccccc54)nc(-n4c5ccccc5c5ccccc54)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)nc4)c3)n2)cc1.
What is the InChIKey of 9-[4-carbazol-9-yl-6-(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[3-carbazol-9-yl-5-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;9-[5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-pyridinyl]carbazole?
The InChIKey is BPNRSYUDHWIQJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C47H31N3.C45H29N5.C38H25N5/c1-3-15-32(16-4-1)42-29-35(30-43(48-42)33-17-5-2-6-18-33)34-27-36(49-44-23-11-7-19-38(44)39-20-8-12-24-45(39)49)31-37(28-34)50-46-25-13-9-21-40(46)41-22-10-14-26-47(41)50;1-3-15-30(16-4-1)32-27-33(31-17-5-2-6-18-31)29-34(28-32)43-46-44(49-39-23-11-7-19-35(39)36-20-8-12-24-40(36)49)48-45(47-43)50-41-25-13-9-21-37(41)38-22-10-14-26-42(38)50;1-3-12-26(13-4-1)36-40-37(27-14-5-2-6-15-27)42-38(41-36)29-17-11-16-28(24-29)30-22-23-35(39-25-30)43-33-20-9-7-18-31(33)32-19-8-10-21-34(32)43/h1-31H;1-29H;1-25H.
What are the key properties of 9-[4-carbazol-9-yl-6-(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[3-carbazol-9-yl-5-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;9-[5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-pyridinyl]carbazole?
9-[4-carbazol-9-yl-6-(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[3-carbazol-9-yl-5-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;9-[5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-pyridinyl]carbazole has a molecular weight of 1829.20 g/mol, XLogP of 32.38, 15 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-carbazol-9-yl-6-(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[3-carbazol-9-yl-5-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;9-[5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-pyridinyl]carbazole is sourced from PubChem (CID 157422186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).