2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-fluorophenyl]-4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazine;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenylcarbazole;3-phenyl-9H-fluorene

C109H72FN13 — CID 163551186

IUPAC2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-fluorophenyl]-4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazine;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenylcarbazole;3-phenyl-9H-fluorene
SMILES[2H]c1c([2H])c([2H])c(-c2nc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc3-n3c4ccccc4c4cc(-c5ccccc5)ccc43)n2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2nc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc3F)n2)c([2H])c1[2H].c1ccc(-c2ccc3c(c2)-c2ccccc2C3)cc1
InChIInChI=1S/C54H35N7.C36H23FN6.C19H14/c1-6-18-36(19-7-1)41-30-32-47-44(34-41)43-28-16-17-29-46(43)61(47)48-33-31-42(53-57-49(37-20-8-2-9-21-37)55-50(58-53)38-22-10-3-11-23-38)35-45(48)54-59-51(39-24-12-4-13-25-39)56-52(60-54)40-26-14-5-15-27-40;37-30-22-21-28(35-40-31(24-13-5-1-6-14-24)38-32(41-35)25-15-7-2-8-16-25)23-29(30)36-42-33(26-17-9-3-10-18-26)39-34(43-36)27-19-11-4-12-20-27;1-2-6-14(7-3-1)15-10-11-17-12-16-8-4-5-9-18(16)19(17)13-15/h1-35H;1-23H;1-11,13H,12H2/i4D,12D,13D,24D,25D;3D,9D,10D,17D,18D;
InChIKeyFJFDZIGAQNBBDG-GJIRQFHOSA-N
MW1592.93 g/mol
LogP25.95
Rot. Bonds15

About 2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-fluorophenyl]-4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazine;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenylcarbazole;3-phenyl-9H-fluorene

2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-fluorophenyl]-4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazine;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenylcarbazole;3-phenyl-9H-fluorene (PubChem CID 163551186) has the molecular formula C109H72FN13 and a molecular weight of 1592.93 g/mol. Its IUPAC name is 2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-fluorophenyl]-4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazine;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenylcarbazole;3-phenyl-9H-fluorene.

Molecular Properties

Compound Name2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-fluorophenyl]-4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazine;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenylcarbazole;3-phenyl-9H-fluorene
PubChem CID163551186
Molecular FormulaC109H72FN13
Molecular Weight1592.93 g/mol
Exact Mass1591.66
IUPAC Name2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-fluorophenyl]-4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazine;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenylcarbazole;3-phenyl-9H-fluorene
SMILES[2H]c1c([2H])c([2H])c(-c2nc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc3-n3c4ccccc4c4cc(-c5ccccc5)ccc43)n2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2nc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc3F)n2)c([2H])c1[2H].c1ccc(-c2ccc3c(c2)-c2ccccc2C3)cc1
InChIInChI=1S/C54H35N7.C36H23FN6.C19H14/c1-6-18-36(19-7-1)41-30-32-47-44(34-41)43-28-16-17-29-46(43)61(47)48-33-31-42(53-57-49(37-20-8-2-9-21-37)55-50(58-53)38-22-10-3-11-23-38)35-45(48)54-59-51(39-24-12-4-13-25-39)56-52(60-54)40-26-14-5-15-27-40;37-30-22-21-28(35-40-31(24-13-5-1-6-14-24)38-32(41-35)25-15-7-2-8-16-25)23-29(30)36-42-33(26-17-9-3-10-18-26)39-34(43-36)27-19-11-4-12-20-27;1-2-6-14(7-3-1)15-10-11-17-12-16-8-4-5-9-18(16)19(17)13-15/h1-35H;1-23H;1-11,13H,12H2/i4D,12D,13D,24D,25D;3D,9D,10D,17D,18D;
InChIKeyFJFDZIGAQNBBDG-GJIRQFHOSA-N
XLogP25.95
TPSA159.61 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds15
Heavy Atoms123
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001592.93
LogP ≤ 525.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Analyze 2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-fluorophenyl]-4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazine;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenylcarbazole;3-phenyl-9H-fluorene with MolForge

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Related Compounds

3,6-diphenyl-9H-fluorene;2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-fluorophenyl]-4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazine;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3,6-diphenylcarbazole
CID 163626217
9-[2,4-bis(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylcarbazole;2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-fluorophenyl]-4,6-diphenyl-1,3,5-triazine;3-phenyl-9H-fluorene
CID 163551188
9-[2-[4,6-bis(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenylcarbazole
CID 162710773
9-[4-(2,3,4,5,6-pentadeuteriophenyl)-2-[4-[6-(2,3,4,5,6-pentadeuteriophenyl)naphthalen-2-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
CID 171720916
1,2,3,4-tetradeuterio-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenylphenyl]-6-(2,3,4,5,6-pentadeuteriophenyl)carbazole
CID 177113607
9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-1-phenylcarbazole
CID 162710811
9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-3-phenylcarbazole;9-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-3-phenylcarbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole
CID 159708925
9-[4-(3,5-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole
CID 138565238
9-[2-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,2,3,4-tetradeuterio-6-(2,3,4,5,6-pentadeuteriophenyl)carbazole
CID 177113366
9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole
CID 157084112
9-[2-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]carbazole
CID 168801624
9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-fluorophenyl)phenyl]carbazole
CID 138549730

Frequently Asked Questions

What is the IUPAC name of 2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-fluorophenyl]-4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazine;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenylcarbazole;3-phenyl-9H-fluorene?
The IUPAC name of 2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-fluorophenyl]-4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazine;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenylcarbazole;3-phenyl-9H-fluorene (CID 163551186) is 2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-fluorophenyl]-4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazine;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenylcarbazole;3-phenyl-9H-fluorene.
What is the SMILES notation for 2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-fluorophenyl]-4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazine;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenylcarbazole;3-phenyl-9H-fluorene?
The canonical SMILES for 2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-fluorophenyl]-4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazine;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenylcarbazole;3-phenyl-9H-fluorene is [2H]c1c([2H])c([2H])c(-c2nc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc3-n3c4ccccc4c4cc(-c5ccccc5)ccc43)n2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2nc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc3F)n2)c([2H])c1[2H].c1ccc(-c2ccc3c(c2)-c2ccccc2C3)cc1.
What is the InChIKey of 2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-fluorophenyl]-4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazine;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenylcarbazole;3-phenyl-9H-fluorene?
The InChIKey is FJFDZIGAQNBBDG-GJIRQFHOSA-N. The full InChI is InChI=1S/C54H35N7.C36H23FN6.C19H14/c1-6-18-36(19-7-1)41-30-32-47-44(34-41)43-28-16-17-29-46(43)61(47)48-33-31-42(53-57-49(37-20-8-2-9-21-37)55-50(58-53)38-22-10-3-11-23-38)35-45(48)54-59-51(39-24-12-4-13-25-39)56-52(60-54)40-26-14-5-15-27-40;37-30-22-21-28(35-40-31(24-13-5-1-6-14-24)38-32(41-35)25-15-7-2-8-16-25)23-29(30)36-42-33(26-17-9-3-10-18-26)39-34(43-36)27-19-11-4-12-20-27;1-2-6-14(7-3-1)15-10-11-17-12-16-8-4-5-9-18(16)19(17)13-15/h1-35H;1-23H;1-11,13H,12H2/i4D,12D,13D,24D,25D;3D,9D,10D,17D,18D;.
What are the key properties of 2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-fluorophenyl]-4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazine;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenylcarbazole;3-phenyl-9H-fluorene?
2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-fluorophenyl]-4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazine;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenylcarbazole;3-phenyl-9H-fluorene has a molecular weight of 1592.93 g/mol, XLogP of 25.95, 15 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-fluorophenyl]-4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazine;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenylcarbazole;3-phenyl-9H-fluorene is sourced from PubChem (CID 163551186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).