2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2,4-dinaphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;8-[4-[4-(4-phenylphenyl)-6-(4-quinolin-8-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline

C135H93N11 — CID 161276945

IUPAC2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2,4-dinaphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;8-[4-[4-(4-phenylphenyl)-6-(4-quinolin-8-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccc(-c6ccc7c(c6)C(C)(C)c6ccccc6-7)cc5)n4)cc3)cc21.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5cccc6cccnc56)cc4)nc(-c4ccc(-c5cccc6cccnc56)cc4)n3)cc2)cc1.c1ccc2cc(-c3nc(-c4ccc(-c5cccc6ccccc56)cc4)nc(-c4ccc5ccccc5c4)n3)ccc2c1
InChIInChI=1S/C51H39N3.C45H29N5.C39H25N3/c1-50(2)43-16-10-8-14-39(43)41-28-26-37(30-45(41)50)32-18-22-35(23-19-32)48-52-47(34-12-6-5-7-13-34)53-49(54-48)36-24-20-33(21-25-36)38-27-29-42-40-15-9-11-17-44(40)51(3,4)46(42)31-38;1-2-8-30(9-3-1)31-16-22-36(23-17-31)43-48-44(37-24-18-32(19-25-37)39-14-4-10-34-12-6-28-46-41(34)39)50-45(49-43)38-26-20-33(21-27-38)40-15-5-11-35-13-7-29-47-42(35)40;1-3-11-31-24-33(22-16-26(31)8-1)38-40-37(41-39(42-38)34-23-17-27-9-2-4-12-32(27)25-34)30-20-18-29(19-21-30)36-15-7-13-28-10-5-6-14-35(28)36/h5-31H,1-4H3;1-29H;1-25H
InChIKeyVEOGGKZNGKKYNF-UHFFFAOYSA-N
MW1869.31 g/mol
LogP33.79
Rot. Bonds15

About 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2,4-dinaphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;8-[4-[4-(4-phenylphenyl)-6-(4-quinolin-8-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline

2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2,4-dinaphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;8-[4-[4-(4-phenylphenyl)-6-(4-quinolin-8-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline (PubChem CID 161276945) has the molecular formula C135H93N11 and a molecular weight of 1869.31 g/mol. Its IUPAC name is 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2,4-dinaphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;8-[4-[4-(4-phenylphenyl)-6-(4-quinolin-8-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline.

Molecular Properties

Compound Name2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2,4-dinaphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;8-[4-[4-(4-phenylphenyl)-6-(4-quinolin-8-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline
PubChem CID161276945
Molecular FormulaC135H93N11
Molecular Weight1869.31 g/mol
Exact Mass1867.76
IUPAC Name2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2,4-dinaphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;8-[4-[4-(4-phenylphenyl)-6-(4-quinolin-8-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccc(-c6ccc7c(c6)C(C)(C)c6ccccc6-7)cc5)n4)cc3)cc21.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5cccc6cccnc56)cc4)nc(-c4ccc(-c5cccc6cccnc56)cc4)n3)cc2)cc1.c1ccc2cc(-c3nc(-c4ccc(-c5cccc6ccccc56)cc4)nc(-c4ccc5ccccc5c4)n3)ccc2c1
InChIInChI=1S/C51H39N3.C45H29N5.C39H25N3/c1-50(2)43-16-10-8-14-39(43)41-28-26-37(30-45(41)50)32-18-22-35(23-19-32)48-52-47(34-12-6-5-7-13-34)53-49(54-48)36-24-20-33(21-25-36)38-27-29-42-40-15-9-11-17-44(40)51(3,4)46(42)31-38;1-2-8-30(9-3-1)31-16-22-36(23-17-31)43-48-44(37-24-18-32(19-25-37)39-14-4-10-34-12-6-28-46-41(34)39)50-45(49-43)38-26-20-33(21-27-38)40-15-5-11-35-13-7-29-47-42(35)40;1-3-11-31-24-33(22-16-26(31)8-1)38-40-37(41-39(42-38)34-23-17-27-9-2-4-12-32(27)25-34)30-20-18-29(19-21-30)36-15-7-13-28-10-5-6-14-35(28)36/h5-31H,1-4H3;1-29H;1-25H
InChIKeyVEOGGKZNGKKYNF-UHFFFAOYSA-N
XLogP33.79
TPSA141.79 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds15
Heavy Atoms146
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001869.31
LogP ≤ 533.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2,4-dinaphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;8-[4-[4-(4-phenylphenyl)-6-(4-quinolin-8-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline with MolForge

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Related Compounds

2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;8-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]quinoline;8-[4-[4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenanthren-9-yl-6-(4-phenanthren-9-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline
CID 165041588
2-(11,11-dimethylbenzo[h]fluoren-1-yl)-4,6-diphenylpyrimidine;2-(9,9-dimethylfluoren-1-yl)-4,6-bis(4-naphthalen-2-ylphenyl)pyrimidine;2-(9,9-dimethylfluoren-1-yl)-4-(4-naphthalen-1-ylphenyl)-6-phenylpyrimidine;8-[4-[2-(9,9-dimethylfluoren-1-yl)-6-phenylpyrimidin-4-yl]phenyl]quinoline
CID 158193977
2-(9,9-dimethylfluoren-2-yl)-4-(4-naphthalen-1-ylphenyl)-6-phenyl-1,3,5-triazine
CID 162504612
2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-9-[3-(6-naphthalen-2-yl-2-phenylpyrimidin-4-yl)phenyl]-1,10-phenanthroline;2-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-9-(4-naphthalen-1-ylphenyl)-1,10-phenanthroline;2-(3-naphthalen-2-ylphenyl)-9-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-1,10-phenanthroline
CID 158744831
8-[6-(4-naphthalen-1-yl-2-pyridinyl)-2-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)pyrimidin-4-yl]quinoline
CID 118652370
2-[4-[4-[4-[4-(9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]naphthalen-1-yl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 129228023
2-[9,9-dimethyl-7-[4-(4-naphthalen-1-ylphenyl)phenyl]fluoren-2-yl]-9,9-dimethyl-7-[4-(4-naphthalen-2-ylphenyl)phenyl]fluorene
CID 123907813
8-[4-[4-(10,10-dimethyl-19-pentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,14,16(21),17,19-decaenyl)-6-phenylpyrimidin-2-yl]phenyl]quinoline
CID 153288173
4-[4-[4-(9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]-6-(3-naphthalen-1-ylphenyl)-2-phenylpyrimidine
CID 168777678
2-[4-[1-[2-[4-(9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]naphthalen-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 129228067
2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine
CID 118427115
4-[4-[3-(9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]-6-(4-naphthalen-1-ylphenyl)-2-phenylpyrimidine
CID 168778898

Frequently Asked Questions

What is the IUPAC name of 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2,4-dinaphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;8-[4-[4-(4-phenylphenyl)-6-(4-quinolin-8-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline?
The IUPAC name of 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2,4-dinaphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;8-[4-[4-(4-phenylphenyl)-6-(4-quinolin-8-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline (CID 161276945) is 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2,4-dinaphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;8-[4-[4-(4-phenylphenyl)-6-(4-quinolin-8-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline.
What is the SMILES notation for 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2,4-dinaphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;8-[4-[4-(4-phenylphenyl)-6-(4-quinolin-8-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline?
The canonical SMILES for 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2,4-dinaphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;8-[4-[4-(4-phenylphenyl)-6-(4-quinolin-8-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline is CC1(C)c2ccccc2-c2ccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccc(-c6ccc7c(c6)C(C)(C)c6ccccc6-7)cc5)n4)cc3)cc21.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5cccc6cccnc56)cc4)nc(-c4ccc(-c5cccc6cccnc56)cc4)n3)cc2)cc1.c1ccc2cc(-c3nc(-c4ccc(-c5cccc6ccccc56)cc4)nc(-c4ccc5ccccc5c4)n3)ccc2c1.
What is the InChIKey of 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2,4-dinaphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;8-[4-[4-(4-phenylphenyl)-6-(4-quinolin-8-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline?
The InChIKey is VEOGGKZNGKKYNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H39N3.C45H29N5.C39H25N3/c1-50(2)43-16-10-8-14-39(43)41-28-26-37(30-45(41)50)32-18-22-35(23-19-32)48-52-47(34-12-6-5-7-13-34)53-49(54-48)36-24-20-33(21-25-36)38-27-29-42-40-15-9-11-17-44(40)51(3,4)46(42)31-38;1-2-8-30(9-3-1)31-16-22-36(23-17-31)43-48-44(37-24-18-32(19-25-37)39-14-4-10-34-12-6-28-46-41(34)39)50-45(49-43)38-26-20-33(21-27-38)40-15-5-11-35-13-7-29-47-42(35)40;1-3-11-31-24-33(22-16-26(31)8-1)38-40-37(41-39(42-38)34-23-17-27-9-2-4-12-32(27)25-34)30-20-18-29(19-21-30)36-15-7-13-28-10-5-6-14-35(28)36/h5-31H,1-4H3;1-29H;1-25H.
What are the key properties of 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2,4-dinaphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;8-[4-[4-(4-phenylphenyl)-6-(4-quinolin-8-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline?
2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2,4-dinaphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;8-[4-[4-(4-phenylphenyl)-6-(4-quinolin-8-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline has a molecular weight of 1869.31 g/mol, XLogP of 33.79, 15 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2,4-dinaphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;8-[4-[4-(4-phenylphenyl)-6-(4-quinolin-8-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline is sourced from PubChem (CID 161276945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).