2,4-diphenyl-6-[3-[6-(9-phenyl-9-pyridin-4-ylfluoren-4-yl)-2-pyridinyl]phenyl]-1,3,5-triazine

C50H33N5 — CID 142385297

IUPAC2,4-diphenyl-6-[3-[6-(9-phenyl-9-pyridin-4-ylfluoren-4-yl)-2-pyridinyl]phenyl]-1,3,5-triazine
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4cccc(-c5cccc6c5-c5ccccc5C6(c5ccccc5)c5ccncc5)n4)c3)n2)cc1
InChIInChI=1S/C50H33N5/c1-4-15-34(16-5-1)47-53-48(35-17-6-2-7-18-35)55-49(54-47)37-20-12-19-36(33-37)44-27-14-28-45(52-44)41-24-13-26-43-46(41)40-23-10-11-25-42(40)50(43,38-21-8-3-9-22-38)39-29-31-51-32-30-39/h1-33H
InChIKeyKBTZFEVXLZSKAJ-UHFFFAOYSA-N
MW703.85 g/mol
LogP11.36
Rot. Bonds7

About 2,4-diphenyl-6-[3-[6-(9-phenyl-9-pyridin-4-ylfluoren-4-yl)-2-pyridinyl]phenyl]-1,3,5-triazine

2,4-diphenyl-6-[3-[6-(9-phenyl-9-pyridin-4-ylfluoren-4-yl)-2-pyridinyl]phenyl]-1,3,5-triazine (PubChem CID 142385297) has the molecular formula C50H33N5 and a molecular weight of 703.85 g/mol. Its IUPAC name is 2,4-diphenyl-6-[3-[6-(9-phenyl-9-pyridin-4-ylfluoren-4-yl)-2-pyridinyl]phenyl]-1,3,5-triazine.

Molecular Properties

Compound Name2,4-diphenyl-6-[3-[6-(9-phenyl-9-pyridin-4-ylfluoren-4-yl)-2-pyridinyl]phenyl]-1,3,5-triazine
PubChem CID142385297
Molecular FormulaC50H33N5
Molecular Weight703.85 g/mol
Exact Mass703.27
IUPAC Name2,4-diphenyl-6-[3-[6-(9-phenyl-9-pyridin-4-ylfluoren-4-yl)-2-pyridinyl]phenyl]-1,3,5-triazine
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4cccc(-c5cccc6c5-c5ccccc5C6(c5ccccc5)c5ccncc5)n4)c3)n2)cc1
InChIInChI=1S/C50H33N5/c1-4-15-34(16-5-1)47-53-48(35-17-6-2-7-18-35)55-49(54-47)37-20-12-19-36(33-37)44-27-14-28-45(52-44)41-24-13-26-43-46(41)40-23-10-11-25-42(40)50(43,38-21-8-3-9-22-38)39-29-31-51-32-30-39/h1-33H
InChIKeyKBTZFEVXLZSKAJ-UHFFFAOYSA-N
XLogP11.36
TPSA64.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500703.85
LogP ≤ 511.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2,4-diphenyl-6-[3-[6-(9-phenyl-9-pyridin-4-ylfluoren-4-yl)-2-pyridinyl]phenyl]-1,3,5-triazine with MolForge

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Launch Full Analysis

Related Compounds

(Z)-but-2-ene;cyclohexa-1,3-diene;2,4-diphenyl-6-[3-[6-(9-phenyl-9-pyridin-4-ylfluoren-4-yl)-2-pyridinyl]phenyl]-1,3,5-triazine
CID 142385296
2-(3-phenylphenyl)-4-pyridin-4-yl-6-[3-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine
CID 146632404
2-(9,9-diphenylfluoren-2-yl)-4,6-diphenyl-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-4-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2,4-diphenyl-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine
CID 160879933
2,4-bis(3-phenylphenyl)-6-(9-phenyl-9-pyridin-4-ylfluoren-2-yl)pyrimidine;ethane
CID 142385444
2,4-diphenyl-6-[3-[3-(9-phenyl-9-pyridin-3-ylfluoren-4-yl)phenyl]phenyl]pyrimidine
CID 142385241
4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine
CID 164785729
2-[3-(9,9-diphenylfluoren-4-yl)phenyl]-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine
CID 146649016
2-phenyl-4-(3-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazine
CID 167178263
2,4-diphenyl-6-(4,9,9-triphenylfluoren-2-yl)-1,3,5-triazine
CID 170441826
2-phenyl-4-(4-phenylphenyl)-6-(9-phenyl-9-pyridin-4-ylfluoren-2-yl)pyrimidine
CID 142385446
4-(9,9-diphenylfluoren-4-yl)-2-(3-phenylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine
CID 146631900
2,4-diphenyl-6-[3-[3-(9-phenylfluoren-9-yl)phenyl]phenyl]-1,3,5-triazine
CID 130375016

Frequently Asked Questions

What is the IUPAC name of 2,4-diphenyl-6-[3-[6-(9-phenyl-9-pyridin-4-ylfluoren-4-yl)-2-pyridinyl]phenyl]-1,3,5-triazine?
The IUPAC name of 2,4-diphenyl-6-[3-[6-(9-phenyl-9-pyridin-4-ylfluoren-4-yl)-2-pyridinyl]phenyl]-1,3,5-triazine (CID 142385297) is 2,4-diphenyl-6-[3-[6-(9-phenyl-9-pyridin-4-ylfluoren-4-yl)-2-pyridinyl]phenyl]-1,3,5-triazine.
What is the SMILES notation for 2,4-diphenyl-6-[3-[6-(9-phenyl-9-pyridin-4-ylfluoren-4-yl)-2-pyridinyl]phenyl]-1,3,5-triazine?
The canonical SMILES for 2,4-diphenyl-6-[3-[6-(9-phenyl-9-pyridin-4-ylfluoren-4-yl)-2-pyridinyl]phenyl]-1,3,5-triazine is c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4cccc(-c5cccc6c5-c5ccccc5C6(c5ccccc5)c5ccncc5)n4)c3)n2)cc1.
What is the InChIKey of 2,4-diphenyl-6-[3-[6-(9-phenyl-9-pyridin-4-ylfluoren-4-yl)-2-pyridinyl]phenyl]-1,3,5-triazine?
The InChIKey is KBTZFEVXLZSKAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H33N5/c1-4-15-34(16-5-1)47-53-48(35-17-6-2-7-18-35)55-49(54-47)37-20-12-19-36(33-37)44-27-14-28-45(52-44)41-24-13-26-43-46(41)40-23-10-11-25-42(40)50(43,38-21-8-3-9-22-38)39-29-31-51-32-30-39/h1-33H.
What are the key properties of 2,4-diphenyl-6-[3-[6-(9-phenyl-9-pyridin-4-ylfluoren-4-yl)-2-pyridinyl]phenyl]-1,3,5-triazine?
2,4-diphenyl-6-[3-[6-(9-phenyl-9-pyridin-4-ylfluoren-4-yl)-2-pyridinyl]phenyl]-1,3,5-triazine has a molecular weight of 703.85 g/mol, XLogP of 11.36, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diphenyl-6-[3-[6-(9-phenyl-9-pyridin-4-ylfluoren-4-yl)-2-pyridinyl]phenyl]-1,3,5-triazine is sourced from PubChem (CID 142385297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).