2-[7-[9-[[4-[4-[4-[7-(9,9-dimethylfluoren-4-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]methyl]-9-methylfluoren-4-yl]naphthalen-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine

C88H60N6 — CID 167178291

IUPAC2-[7-[9-[[4-[4-[4-[7-(9,9-dimethylfluoren-4-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]methyl]-9-methylfluoren-4-yl]naphthalen-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine
SMILESCC1(C)c2ccccc2-c2c(-c3ccc4ccc(-c5ncnc(-c6ccc(-c7ccc(CC8(C)c9ccccc9-c9c(-c%10ccc%11ccc(-c%12nc(-c%13ccc%14ccccc%14c%13)nc(-c%13ccc%14ccccc%14c%13)n%12)cc%11c%10)cccc98)cc7)cc6)n5)cc4c3)cccc21
InChIInChI=1S/C88H60N6/c1-87(2)76-22-10-8-18-74(76)80-72(20-12-24-78(80)87)64-40-32-59-36-42-66(50-70(59)48-64)83-90-53-89-82(91-83)61-38-30-58(31-39-61)57-28-26-54(27-29-57)52-88(3)77-23-11-9-19-75(77)81-73(21-13-25-79(81)88)65-41-33-60-37-45-69(51-71(60)49-65)86-93-84(67-43-34-55-14-4-6-16-62(55)46-67)92-85(94-86)68-44-35-56-15-5-7-17-63(56)47-68/h4-51,53H,52H2,1-3H3
InChIKeyWLMPWRCPECELPJ-UHFFFAOYSA-N
MW1201.49 g/mol
LogP21.84
Rot. Bonds10

About 2-[7-[9-[[4-[4-[4-[7-(9,9-dimethylfluoren-4-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]methyl]-9-methylfluoren-4-yl]naphthalen-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine

2-[7-[9-[[4-[4-[4-[7-(9,9-dimethylfluoren-4-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]methyl]-9-methylfluoren-4-yl]naphthalen-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine (PubChem CID 167178291) has the molecular formula C88H60N6 and a molecular weight of 1201.49 g/mol. Its IUPAC name is 2-[7-[9-[[4-[4-[4-[7-(9,9-dimethylfluoren-4-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]methyl]-9-methylfluoren-4-yl]naphthalen-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine.

Molecular Properties

Compound Name2-[7-[9-[[4-[4-[4-[7-(9,9-dimethylfluoren-4-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]methyl]-9-methylfluoren-4-yl]naphthalen-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine
PubChem CID167178291
Molecular FormulaC88H60N6
Molecular Weight1201.49 g/mol
Exact Mass1200.49
IUPAC Name2-[7-[9-[[4-[4-[4-[7-(9,9-dimethylfluoren-4-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]methyl]-9-methylfluoren-4-yl]naphthalen-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine
SMILESCC1(C)c2ccccc2-c2c(-c3ccc4ccc(-c5ncnc(-c6ccc(-c7ccc(CC8(C)c9ccccc9-c9c(-c%10ccc%11ccc(-c%12nc(-c%13ccc%14ccccc%14c%13)nc(-c%13ccc%14ccccc%14c%13)n%12)cc%11c%10)cccc98)cc7)cc6)n5)cc4c3)cccc21
InChIInChI=1S/C88H60N6/c1-87(2)76-22-10-8-18-74(76)80-72(20-12-24-78(80)87)64-40-32-59-36-42-66(50-70(59)48-64)83-90-53-89-82(91-83)61-38-30-58(31-39-61)57-28-26-54(27-29-57)52-88(3)77-23-11-9-19-75(77)81-73(21-13-25-79(81)88)65-41-33-60-37-45-69(51-71(60)49-65)86-93-84(67-43-34-55-14-4-6-16-62(55)46-67)92-85(94-86)68-44-35-56-15-5-7-17-63(56)47-68/h4-51,53H,52H2,1-3H3
InChIKeyWLMPWRCPECELPJ-UHFFFAOYSA-N
XLogP21.84
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms94
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001201.49
LogP ≤ 521.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-[7-[9-[[4-[4-[4-[7-(9,9-dimethylfluoren-4-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]methyl]-9-methylfluoren-4-yl]naphthalen-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine with MolForge

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Related Compounds

2-[7-(9,9-dimethylfluoren-4-yl)naphthalen-1-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine
CID 118426885
2-(9,9-dimethylfluoren-2-yl)-4-(9,9-dimethylfluoren-4-yl)-6-(4-naphthalen-2-ylphenyl)-1,3,5-triazine
CID 170927879
2-[3-(9,9-dimethylfluoren-4-yl)phenyl]-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine
CID 126543666
2-[3,5-bis(9,9-dimethylfluoren-4-yl)phenyl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine
CID 129150850
2-[4-(9,9-dimethylfluoren-3-yl)phenyl]-4,6-dinaphthalen-2-yl-1,3,5-triazine
CID 171592076
2-(9,9-dimethylfluoren-4-yl)-4-naphthalen-2-yl-6-naphtho[2,3-b][1]benzofuran-2-yl-1,3,5-triazine
CID 163527458
2-[4-(9,9-dimethylfluoren-4-yl)phenyl]-4-(3,4-diphenylphenyl)-6-phenyl-1,3,5-triazine
CID 175619642
2-(9,9-dimethylfluoren-4-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 146632838
2-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)-4-(9,9-dimethylfluoren-4-yl)-6-(4-naphthalen-2-ylphenyl)-1,3,5-triazine
CID 170927930
2-(9,9-dimethylfluoren-2-yl)-4-naphthalen-2-yl-6-(7-naphthalen-2-ylnaphthalen-2-yl)-1,3,5-triazine
CID 176588450
2-(9,9-dimethylfluoren-2-yl)-4-(4-phenylphenyl)-1,3,5-triazine
CID 118245460
2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine
CID 118427115

Frequently Asked Questions

What is the IUPAC name of 2-[7-[9-[[4-[4-[4-[7-(9,9-dimethylfluoren-4-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]methyl]-9-methylfluoren-4-yl]naphthalen-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine?
The IUPAC name of 2-[7-[9-[[4-[4-[4-[7-(9,9-dimethylfluoren-4-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]methyl]-9-methylfluoren-4-yl]naphthalen-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine (CID 167178291) is 2-[7-[9-[[4-[4-[4-[7-(9,9-dimethylfluoren-4-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]methyl]-9-methylfluoren-4-yl]naphthalen-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine.
What is the SMILES notation for 2-[7-[9-[[4-[4-[4-[7-(9,9-dimethylfluoren-4-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]methyl]-9-methylfluoren-4-yl]naphthalen-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine?
The canonical SMILES for 2-[7-[9-[[4-[4-[4-[7-(9,9-dimethylfluoren-4-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]methyl]-9-methylfluoren-4-yl]naphthalen-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine is CC1(C)c2ccccc2-c2c(-c3ccc4ccc(-c5ncnc(-c6ccc(-c7ccc(CC8(C)c9ccccc9-c9c(-c%10ccc%11ccc(-c%12nc(-c%13ccc%14ccccc%14c%13)nc(-c%13ccc%14ccccc%14c%13)n%12)cc%11c%10)cccc98)cc7)cc6)n5)cc4c3)cccc21.
What is the InChIKey of 2-[7-[9-[[4-[4-[4-[7-(9,9-dimethylfluoren-4-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]methyl]-9-methylfluoren-4-yl]naphthalen-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine?
The InChIKey is WLMPWRCPECELPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C88H60N6/c1-87(2)76-22-10-8-18-74(76)80-72(20-12-24-78(80)87)64-40-32-59-36-42-66(50-70(59)48-64)83-90-53-89-82(91-83)61-38-30-58(31-39-61)57-28-26-54(27-29-57)52-88(3)77-23-11-9-19-75(77)81-73(21-13-25-79(81)88)65-41-33-60-37-45-69(51-71(60)49-65)86-93-84(67-43-34-55-14-4-6-16-62(55)46-67)92-85(94-86)68-44-35-56-15-5-7-17-63(56)47-68/h4-51,53H,52H2,1-3H3.
What are the key properties of 2-[7-[9-[[4-[4-[4-[7-(9,9-dimethylfluoren-4-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]methyl]-9-methylfluoren-4-yl]naphthalen-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine?
2-[7-[9-[[4-[4-[4-[7-(9,9-dimethylfluoren-4-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]methyl]-9-methylfluoren-4-yl]naphthalen-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine has a molecular weight of 1201.49 g/mol, XLogP of 21.84, 10 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[7-[9-[[4-[4-[4-[7-(9,9-dimethylfluoren-4-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]methyl]-9-methylfluoren-4-yl]naphthalen-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine is sourced from PubChem (CID 167178291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).