2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine

C143H96N12 — CID 157262568

IUPAC2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(-c4ccc(-c5ccccc5)nc4)nc(-c4cccc(-c5ccccc5)c4)n3)cc21.c1ccc(-c2cccc(-c3nc(-c4ccc(-c5ccccn5)cc4)nc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)n3)c2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccc(-c5ccncc5)cc4)nc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)n3)c2)cc1
InChIInChI=1S/C51H32N4.C51H34N4.C41H30N4/c1-2-13-33(14-3-1)36-15-12-16-37(31-36)49-53-48(35-26-24-34(25-27-35)47-23-10-11-30-52-47)54-50(55-49)38-28-29-42-41-19-6-9-22-45(41)51(46(42)32-38)43-20-7-4-17-39(43)40-18-5-8-21-44(40)51;1-4-13-35(14-5-1)39-15-12-16-40(33-39)49-53-48(38-25-23-36(24-26-38)37-29-31-52-32-30-37)54-50(55-49)41-27-28-45-44-21-10-11-22-46(44)51(47(45)34-41,42-17-6-2-7-18-42)43-19-8-3-9-20-43;1-41(2)35-19-10-9-18-33(35)34-22-20-31(25-36(34)41)39-43-38(30-17-11-16-29(24-30)27-12-5-3-6-13-27)44-40(45-39)32-21-23-37(42-26-32)28-14-7-4-8-15-28/h1-32H;1-34H;3-26H,1-2H3
InChIKeyAXPYYXOTYCXZPS-UHFFFAOYSA-N
MW1982.42 g/mol
LogP33.82
Rot. Bonds17

About 2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine

2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine (PubChem CID 157262568) has the molecular formula C143H96N12 and a molecular weight of 1982.42 g/mol. Its IUPAC name is 2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine.

Molecular Properties

Compound Name2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine
PubChem CID157262568
Molecular FormulaC143H96N12
Molecular Weight1982.42 g/mol
Exact Mass1980.79
IUPAC Name2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(-c4ccc(-c5ccccc5)nc4)nc(-c4cccc(-c5ccccc5)c4)n3)cc21.c1ccc(-c2cccc(-c3nc(-c4ccc(-c5ccccn5)cc4)nc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)n3)c2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccc(-c5ccncc5)cc4)nc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)n3)c2)cc1
InChIInChI=1S/C51H32N4.C51H34N4.C41H30N4/c1-2-13-33(14-3-1)36-15-12-16-37(31-36)49-53-48(35-26-24-34(25-27-35)47-23-10-11-30-52-47)54-50(55-49)38-28-29-42-41-19-6-9-22-45(41)51(46(42)32-38)43-20-7-4-17-39(43)40-18-5-8-21-44(40)51;1-4-13-35(14-5-1)39-15-12-16-40(33-39)49-53-48(38-25-23-36(24-26-38)37-29-31-52-32-30-37)54-50(55-49)41-27-28-45-44-21-10-11-22-46(44)51(47(45)34-41,42-17-6-2-7-18-42)43-19-8-3-9-20-43;1-41(2)35-19-10-9-18-33(35)34-22-20-31(25-36(34)41)39-43-38(30-17-11-16-29(24-30)27-12-5-3-6-13-27)44-40(45-39)32-21-23-37(42-26-32)28-14-7-4-8-15-28/h1-32H;1-34H;3-26H,1-2H3
InChIKeyAXPYYXOTYCXZPS-UHFFFAOYSA-N
XLogP33.82
TPSA154.68 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds17
Heavy Atoms155
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001982.42
LogP ≤ 533.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine with MolForge

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Related Compounds

4-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenyl-6-(4-pyridin-4-ylphenyl)pyrimidine;4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenyl-6-(4-pyridin-2-ylphenyl)pyrimidine;2-phenyl-4-(6-phenyl-3-pyridinyl)-6-[3-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrimidine
CID 160814646
4-(9,9-dimethylfluoren-2-yl)-2-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine
CID 162175263
2-[3-[3-[3-(9,9-dimethylfluoren-4-yl)phenyl]phenyl]phenyl]-4-phenyl-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-phenyl-4-(4-pyridin-2-ylphenyl)-6-[3-[3-[3-(9,9'-spirobi[fluorene]-4'-yl)phenyl]phenyl]phenyl]-1,3,5-triazine
CID 160899727
2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-3-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine
CID 159513755
4-(11,11-dimethylbenzo[a]fluoren-9-yl)-2-(4-phenylphenyl)-6-(4-pyridin-2-ylphenyl)pyrimidine;4-(7,7-dimethylbenzo[g]fluoren-9-yl)-2-(4-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-dimethylfluoren-3-yl)-2-(4-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(4-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;4-(9,9-diphenylfluoren-3-yl)-2-(4-phenylphenyl)-6-(4-pyridin-2-ylphenyl)pyrimidine;2-(4-phenylphenyl)-4-(6-phenyl-3-pyridinyl)-6-(9,9'-spirobi[fluorene]-3-yl)pyrimidine
CID 162261187
2-phenyl-4-(6-phenyl-3-pyridinyl)-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine
CID 146633338
6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-3-ylphenyl)quinoxaline;6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-2-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline
CID 159360093
2-[4-[3-(11,11-dimethylbenzo[a]fluoren-8-yl)phenyl]phenyl]-4-phenyl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-[4-[3-(9,9-dimethylfluoren-4-yl)phenyl]phenyl]-4-phenyl-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-phenyl-4-(6-phenyl-3-pyridinyl)-6-[4-[3-(9,9'-spirobi[fluorene]-4'-yl)phenyl]phenyl]-1,3,5-triazine
CID 159087399
2-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-4,6-diphenylpyridine;4-[3-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]phenyl]-4,6-diphenylpyridine;2-[3-(9,9-diphenylfluoren-2-yl)phenyl]-4,6-diphenylpyrimidine;2-[4-(9,9-diphenylfluoren-2-yl)phenyl]-4,6-diphenylpyrimidine;4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2,6-diphenylpyrimidine;4-[4-(9,9-diphenylfluoren-2-yl)phenyl]-2,6-diphenylpyrimidine
CID 163695786
2-phenyl-4-[3-[6-[4-[4-(3-pyridin-2-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl]phenyl]-3-pyridinyl]phenyl]-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazine
CID 139307625
2-methyl-4-(3-phenylphenyl)-6-pyridin-4-yl-1,3,5-triazine;2-methyl-4-(4-phenylphenyl)-6-pyridin-4-yl-1,3,5-triazine;2-methyl-4-phenyl-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-methyl-4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazine
CID 160549129
4-[4-(11,11-dimethylbenzo[a]fluoren-7-yl)phenyl]-6-phenyl-2-(4-pyridin-2-ylphenyl)pyrimidine;4-[4-(7,7-dimethylbenzo[c]fluoren-11-yl)phenyl]-6-phenyl-2-(6-phenyl-3-pyridinyl)pyrimidine;4-[4-(9,9-diphenylfluoren-4-yl)phenyl]-6-phenyl-2-(4-pyridin-4-ylphenyl)pyrimidine
CID 161174872

Frequently Asked Questions

What is the IUPAC name of 2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine?
The IUPAC name of 2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine (CID 157262568) is 2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine.
What is the SMILES notation for 2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine?
The canonical SMILES for 2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine is CC1(C)c2ccccc2-c2ccc(-c3nc(-c4ccc(-c5ccccc5)nc4)nc(-c4cccc(-c5ccccc5)c4)n3)cc21.c1ccc(-c2cccc(-c3nc(-c4ccc(-c5ccccn5)cc4)nc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)n3)c2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccc(-c5ccncc5)cc4)nc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)n3)c2)cc1.
What is the InChIKey of 2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine?
The InChIKey is AXPYYXOTYCXZPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H32N4.C51H34N4.C41H30N4/c1-2-13-33(14-3-1)36-15-12-16-37(31-36)49-53-48(35-26-24-34(25-27-35)47-23-10-11-30-52-47)54-50(55-49)38-28-29-42-41-19-6-9-22-45(41)51(46(42)32-38)43-20-7-4-17-39(43)40-18-5-8-21-44(40)51;1-4-13-35(14-5-1)39-15-12-16-40(33-39)49-53-48(38-25-23-36(24-26-38)37-29-31-52-32-30-37)54-50(55-49)41-27-28-45-44-21-10-11-22-46(44)51(47(45)34-41,42-17-6-2-7-18-42)43-19-8-3-9-20-43;1-41(2)35-19-10-9-18-33(35)34-22-20-31(25-36(34)41)39-43-38(30-17-11-16-29(24-30)27-12-5-3-6-13-27)44-40(45-39)32-21-23-37(42-26-32)28-14-7-4-8-15-28/h1-32H;1-34H;3-26H,1-2H3.
What are the key properties of 2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine?
2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine has a molecular weight of 1982.42 g/mol, XLogP of 33.82, 17 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine is sourced from PubChem (CID 157262568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).