2,4-bis(4-phenylphenyl)-6-[3-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazine;4-[6-[4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-2-phenylpyrimidin-4-yl]benzonitrile;4-[4-[3-[4-(6-dibenzofuran-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;9-phenyl-2-[2-phenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrimidin-4-yl]carbazole;4-[4-phenyl-6-[3-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazin-2-yl]benzonitrile

C277H178N30O — CID 163421741

IUPAC2,4-bis(4-phenylphenyl)-6-[3-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazine;4-[6-[4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-2-phenylpyrimidin-4-yl]benzonitrile;4-[4-[3-[4-(6-dibenzofuran-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;9-phenyl-2-[2-phenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrimidin-4-yl]carbazole;4-[4-phenyl-6-[3-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazin-2-yl]benzonitrile
SMILESN#Cc1ccc(-c2cc(-c3ccc(-c4cccc(-c5nc(-c6ccc(-c7ccccc7)cc6)nc(-c6ccc(-c7ccccc7)cc6)n5)c4)cc3)nc(-c3ccccc3)n2)cc1.N#Cc1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc(-c5cc(-c6ccc(-c7ccccc7)cc6)nc(-c6ccccc6)n5)cc4)c3)n2)cc1.N#Cc1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc(-c5cc(-c6ccc7oc8ccccc8c7c6)nc(-c6ccccc6)n5)cc4)c3)n2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4cccc(-c5ccc(-c6cc(-c7ccc(-c8cccnc8)cc7)nc(-c7ccccc7)n6)cc5)c4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5ccc(-c6cc(-c7ccc8c9ccccc9n(-c9ccccc9)c8c7)nc(-c7ccccc7)n6)cc5)c4)n3)cc2)cc1
InChIInChI=1S/C61H40N6.C60H40N6.C56H36N6.C50H30N6O.C50H32N6/c1-5-16-41(17-6-1)42-30-34-47(35-31-42)60-64-59(46-20-9-3-10-21-46)65-61(66-60)50-23-15-22-48(38-50)43-28-32-44(33-29-43)54-40-55(63-58(62-54)45-18-7-2-8-19-45)49-36-37-53-52-26-13-14-27-56(52)67(57(53)39-49)51-24-11-4-12-25-51;1-4-12-41(13-5-1)43-25-33-50(34-26-43)58-64-59(51-35-27-44(28-36-51)42-14-6-2-7-15-42)66-60(65-58)53-19-10-18-52(38-53)45-21-29-47(30-22-45)55-39-56(63-57(62-55)49-16-8-3-9-17-49)48-31-23-46(24-32-48)54-20-11-37-61-40-54;57-37-38-19-21-44(22-20-38)51-36-52(59-53(58-51)46-15-8-3-9-16-46)45-29-23-43(24-30-45)49-17-10-18-50(35-49)56-61-54(47-31-25-41(26-32-47)39-11-4-1-5-12-39)60-55(62-56)48-33-27-42(28-34-48)40-13-6-2-7-14-40;51-31-32-18-20-37(21-19-32)49-54-48(36-12-5-2-6-13-36)55-50(56-49)40-15-9-14-38(28-40)33-22-24-34(25-23-33)43-30-44(53-47(52-43)35-10-3-1-4-11-35)39-26-27-46-42(29-39)41-16-7-8-17-45(41)57-46;51-33-34-19-21-42(22-20-34)49-54-48(41-15-8-3-9-16-41)55-50(56-49)44-18-10-17-43(31-44)37-25-29-39(30-26-37)46-32-45(52-47(53-46)40-13-6-2-7-14-40)38-27-23-36(24-28-38)35-11-4-1-5-12-35/h1-40H;1-40H;1-36H;1-30H;1-32H
InChIKeyAJACDIKIHFHUNB-UHFFFAOYSA-N
MW3942.68 g/mol
LogP67.33
Rot. Bonds43

About 2,4-bis(4-phenylphenyl)-6-[3-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazine;4-[6-[4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-2-phenylpyrimidin-4-yl]benzonitrile;4-[4-[3-[4-(6-dibenzofuran-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;9-phenyl-2-[2-phenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrimidin-4-yl]carbazole;4-[4-phenyl-6-[3-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazin-2-yl]benzonitrile

2,4-bis(4-phenylphenyl)-6-[3-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazine;4-[6-[4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-2-phenylpyrimidin-4-yl]benzonitrile;4-[4-[3-[4-(6-dibenzofuran-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;9-phenyl-2-[2-phenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrimidin-4-yl]carbazole;4-[4-phenyl-6-[3-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazin-2-yl]benzonitrile (PubChem CID 163421741) has the molecular formula C277H178N30O and a molecular weight of 3942.68 g/mol. Its IUPAC name is 2,4-bis(4-phenylphenyl)-6-[3-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazine;4-[6-[4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-2-phenylpyrimidin-4-yl]benzonitrile;4-[4-[3-[4-(6-dibenzofuran-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;9-phenyl-2-[2-phenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrimidin-4-yl]carbazole;4-[4-phenyl-6-[3-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazin-2-yl]benzonitrile.

Molecular Properties

Compound Name2,4-bis(4-phenylphenyl)-6-[3-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazine;4-[6-[4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-2-phenylpyrimidin-4-yl]benzonitrile;4-[4-[3-[4-(6-dibenzofuran-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;9-phenyl-2-[2-phenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrimidin-4-yl]carbazole;4-[4-phenyl-6-[3-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazin-2-yl]benzonitrile
PubChem CID163421741
Molecular FormulaC277H178N30O
Molecular Weight3942.68 g/mol
Exact Mass3939.48
IUPAC Name2,4-bis(4-phenylphenyl)-6-[3-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazine;4-[6-[4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-2-phenylpyrimidin-4-yl]benzonitrile;4-[4-[3-[4-(6-dibenzofuran-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;9-phenyl-2-[2-phenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrimidin-4-yl]carbazole;4-[4-phenyl-6-[3-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazin-2-yl]benzonitrile
SMILESN#Cc1ccc(-c2cc(-c3ccc(-c4cccc(-c5nc(-c6ccc(-c7ccccc7)cc6)nc(-c6ccc(-c7ccccc7)cc6)n5)c4)cc3)nc(-c3ccccc3)n2)cc1.N#Cc1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc(-c5cc(-c6ccc(-c7ccccc7)cc6)nc(-c6ccccc6)n5)cc4)c3)n2)cc1.N#Cc1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc(-c5cc(-c6ccc7oc8ccccc8c7c6)nc(-c6ccccc6)n5)cc4)c3)n2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4cccc(-c5ccc(-c6cc(-c7ccc(-c8cccnc8)cc7)nc(-c7ccccc7)n6)cc5)c4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5ccc(-c6cc(-c7ccc8c9ccccc9n(-c9ccccc9)c8c7)nc(-c7ccccc7)n6)cc5)c4)n3)cc2)cc1
InChIInChI=1S/C61H40N6.C60H40N6.C56H36N6.C50H30N6O.C50H32N6/c1-5-16-41(17-6-1)42-30-34-47(35-31-42)60-64-59(46-20-9-3-10-21-46)65-61(66-60)50-23-15-22-48(38-50)43-28-32-44(33-29-43)54-40-55(63-58(62-54)45-18-7-2-8-19-45)49-36-37-53-52-26-13-14-27-56(52)67(57(53)39-49)51-24-11-4-12-25-51;1-4-12-41(13-5-1)43-25-33-50(34-26-43)58-64-59(51-35-27-44(28-36-51)42-14-6-2-7-15-42)66-60(65-58)53-19-10-18-52(38-53)45-21-29-47(30-22-45)55-39-56(63-57(62-55)49-16-8-3-9-17-49)48-31-23-46(24-32-48)54-20-11-37-61-40-54;57-37-38-19-21-44(22-20-38)51-36-52(59-53(58-51)46-15-8-3-9-16-46)45-29-23-43(24-30-45)49-17-10-18-50(35-49)56-61-54(47-31-25-41(26-32-47)39-11-4-1-5-12-39)60-55(62-56)48-33-27-42(28-34-48)40-13-6-2-7-14-40;51-31-32-18-20-37(21-19-32)49-54-48(36-12-5-2-6-13-36)55-50(56-49)40-15-9-14-38(28-40)33-22-24-34(25-23-33)43-30-44(53-47(52-43)35-10-3-1-4-11-35)39-26-27-46-42(29-39)41-16-7-8-17-45(41)57-46;51-33-34-19-21-42(22-20-34)49-54-48(41-15-8-3-9-16-41)55-50(56-49)44-18-10-17-43(31-44)37-25-29-39(30-26-37)46-32-45(52-47(53-46)40-13-6-2-7-14-40)38-27-23-36(24-28-38)35-11-4-1-5-12-35/h1-40H;1-40H;1-36H;1-30H;1-32H
InChIKeyAJACDIKIHFHUNB-UHFFFAOYSA-N
XLogP67.33
TPSA424.58 Ų
H-Bond Donors
H-Bond Acceptors31
Rotatable Bonds43
Heavy Atoms308
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003942.68
LogP ≤ 567.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1031

Analyze 2,4-bis(4-phenylphenyl)-6-[3-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazine;4-[6-[4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-2-phenylpyrimidin-4-yl]benzonitrile;4-[4-[3-[4-(6-dibenzofuran-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;9-phenyl-2-[2-phenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrimidin-4-yl]carbazole;4-[4-phenyl-6-[3-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazin-2-yl]benzonitrile with MolForge

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Related Compounds

11-phenyl-8-[4-[4-phenyl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-[1]benzofuro[3,2-b]carbazole
CID 164843565
3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-2-yl]-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole
CID 70659228
2-[8-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole
CID 139342775
9-(4-dibenzofuran-2-ylphenyl)-3-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(4-dibenzofuran-2-ylphenyl)-3-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole
CID 159961245
4-[3-dibenzofuran-2-yl-5-(3-phenylphenyl)phenyl]-2-phenyl-6-(3-pyridin-3-ylphenyl)pyrimidine
CID 171583697
2-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)-9-phenylcarbazole
CID 146367342
4-[9-[4-dibenzofuran-2-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-2-yl]benzonitrile
CID 155232240
2-dibenzofuran-2-yl-9-[4-phenyl-6-(9-phenylcarbazol-2-yl)-1,3,5-triazin-2-yl]carbazole
CID 164970157
9-[3-carbazol-9-yl-5-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]carbazole;9-[3-carbazol-9-yl-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]carbazole;4-[3,5-di(dibenzofuran-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine
CID 158561754
9-[8-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]dibenzofuran-3-yl]carbazole
CID 166952321
2-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-11-phenyl-[1]benzofuro[3,2-b]carbazole
CID 163556848
3-[8-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-9-phenylcarbazole
CID 139342236

Frequently Asked Questions

What is the IUPAC name of 2,4-bis(4-phenylphenyl)-6-[3-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazine;4-[6-[4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-2-phenylpyrimidin-4-yl]benzonitrile;4-[4-[3-[4-(6-dibenzofuran-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;9-phenyl-2-[2-phenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrimidin-4-yl]carbazole;4-[4-phenyl-6-[3-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazin-2-yl]benzonitrile?
The IUPAC name of 2,4-bis(4-phenylphenyl)-6-[3-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazine;4-[6-[4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-2-phenylpyrimidin-4-yl]benzonitrile;4-[4-[3-[4-(6-dibenzofuran-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;9-phenyl-2-[2-phenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrimidin-4-yl]carbazole;4-[4-phenyl-6-[3-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazin-2-yl]benzonitrile (CID 163421741) is 2,4-bis(4-phenylphenyl)-6-[3-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazine;4-[6-[4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-2-phenylpyrimidin-4-yl]benzonitrile;4-[4-[3-[4-(6-dibenzofuran-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;9-phenyl-2-[2-phenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrimidin-4-yl]carbazole;4-[4-phenyl-6-[3-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazin-2-yl]benzonitrile.
What is the SMILES notation for 2,4-bis(4-phenylphenyl)-6-[3-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazine;4-[6-[4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-2-phenylpyrimidin-4-yl]benzonitrile;4-[4-[3-[4-(6-dibenzofuran-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;9-phenyl-2-[2-phenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrimidin-4-yl]carbazole;4-[4-phenyl-6-[3-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazin-2-yl]benzonitrile?
The canonical SMILES for 2,4-bis(4-phenylphenyl)-6-[3-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazine;4-[6-[4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-2-phenylpyrimidin-4-yl]benzonitrile;4-[4-[3-[4-(6-dibenzofuran-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;9-phenyl-2-[2-phenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrimidin-4-yl]carbazole;4-[4-phenyl-6-[3-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazin-2-yl]benzonitrile is N#Cc1ccc(-c2cc(-c3ccc(-c4cccc(-c5nc(-c6ccc(-c7ccccc7)cc6)nc(-c6ccc(-c7ccccc7)cc6)n5)c4)cc3)nc(-c3ccccc3)n2)cc1.N#Cc1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc(-c5cc(-c6ccc(-c7ccccc7)cc6)nc(-c6ccccc6)n5)cc4)c3)n2)cc1.N#Cc1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc(-c5cc(-c6ccc7oc8ccccc8c7c6)nc(-c6ccccc6)n5)cc4)c3)n2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4cccc(-c5ccc(-c6cc(-c7ccc(-c8cccnc8)cc7)nc(-c7ccccc7)n6)cc5)c4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5ccc(-c6cc(-c7ccc8c9ccccc9n(-c9ccccc9)c8c7)nc(-c7ccccc7)n6)cc5)c4)n3)cc2)cc1.
What is the InChIKey of 2,4-bis(4-phenylphenyl)-6-[3-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazine;4-[6-[4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-2-phenylpyrimidin-4-yl]benzonitrile;4-[4-[3-[4-(6-dibenzofuran-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;9-phenyl-2-[2-phenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrimidin-4-yl]carbazole;4-[4-phenyl-6-[3-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazin-2-yl]benzonitrile?
The InChIKey is AJACDIKIHFHUNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H40N6.C60H40N6.C56H36N6.C50H30N6O.C50H32N6/c1-5-16-41(17-6-1)42-30-34-47(35-31-42)60-64-59(46-20-9-3-10-21-46)65-61(66-60)50-23-15-22-48(38-50)43-28-32-44(33-29-43)54-40-55(63-58(62-54)45-18-7-2-8-19-45)49-36-37-53-52-26-13-14-27-56(52)67(57(53)39-49)51-24-11-4-12-25-51;1-4-12-41(13-5-1)43-25-33-50(34-26-43)58-64-59(51-35-27-44(28-36-51)42-14-6-2-7-15-42)66-60(65-58)53-19-10-18-52(38-53)45-21-29-47(30-22-45)55-39-56(63-57(62-55)49-16-8-3-9-17-49)48-31-23-46(24-32-48)54-20-11-37-61-40-54;57-37-38-19-21-44(22-20-38)51-36-52(59-53(58-51)46-15-8-3-9-16-46)45-29-23-43(24-30-45)49-17-10-18-50(35-49)56-61-54(47-31-25-41(26-32-47)39-11-4-1-5-12-39)60-55(62-56)48-33-27-42(28-34-48)40-13-6-2-7-14-40;51-31-32-18-20-37(21-19-32)49-54-48(36-12-5-2-6-13-36)55-50(56-49)40-15-9-14-38(28-40)33-22-24-34(25-23-33)43-30-44(53-47(52-43)35-10-3-1-4-11-35)39-26-27-46-42(29-39)41-16-7-8-17-45(41)57-46;51-33-34-19-21-42(22-20-34)49-54-48(41-15-8-3-9-16-41)55-50(56-49)44-18-10-17-43(31-44)37-25-29-39(30-26-37)46-32-45(52-47(53-46)40-13-6-2-7-14-40)38-27-23-36(24-28-38)35-11-4-1-5-12-35/h1-40H;1-40H;1-36H;1-30H;1-32H.
What are the key properties of 2,4-bis(4-phenylphenyl)-6-[3-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazine;4-[6-[4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-2-phenylpyrimidin-4-yl]benzonitrile;4-[4-[3-[4-(6-dibenzofuran-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;9-phenyl-2-[2-phenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrimidin-4-yl]carbazole;4-[4-phenyl-6-[3-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazin-2-yl]benzonitrile?
2,4-bis(4-phenylphenyl)-6-[3-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazine;4-[6-[4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-2-phenylpyrimidin-4-yl]benzonitrile;4-[4-[3-[4-(6-dibenzofuran-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;9-phenyl-2-[2-phenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrimidin-4-yl]carbazole;4-[4-phenyl-6-[3-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazin-2-yl]benzonitrile has a molecular weight of 3942.68 g/mol, XLogP of 67.33, 43 rotatable bonds, 0 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-bis(4-phenylphenyl)-6-[3-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazine;4-[6-[4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-2-phenylpyrimidin-4-yl]benzonitrile;4-[4-[3-[4-(6-dibenzofuran-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;9-phenyl-2-[2-phenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrimidin-4-yl]carbazole;4-[4-phenyl-6-[3-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazin-2-yl]benzonitrile is sourced from PubChem (CID 163421741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).