2-[6-[4-(3,5-diphenylphenyl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]-4,6-diphenyl-1,3,5-triazine;1-[6-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-4-naphthalen-1-yl-2-pyridinyl]isoquinoline;9-[3-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]carbazole

C140H91N19 — CID 164973724

IUPAC2-[6-[4-(3,5-diphenylphenyl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]-4,6-diphenyl-1,3,5-triazine;1-[6-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-4-naphthalen-1-yl-2-pyridinyl]isoquinoline;9-[3-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3cc(-c4ccccn4)nc(-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cn4)c3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cc(-c5cccc(-n6c7ccccc7c7ccccc76)c5)cc(-c5ccccn5)n4)nc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cc(-c5cccc6ccccc56)cc(-c5nccc6ccccc56)n4)nc3)n2)cc1
InChIInChI=1S/C48H31N7.C48H32N6.C44H28N6/c1-3-14-32(15-4-1)46-52-47(33-16-5-2-6-17-33)54-48(53-46)35-25-26-41(50-31-35)43-30-36(29-42(51-43)40-22-11-12-27-49-40)34-18-13-19-37(28-34)55-44-23-9-7-20-38(44)39-21-8-10-24-45(39)55;1-5-15-33(16-6-1)38-27-39(34-17-7-2-8-18-34)29-40(28-38)41-30-44(42-23-13-14-26-49-42)51-45(31-41)43-25-24-37(32-50-43)48-53-46(35-19-9-3-10-20-35)52-47(54-48)36-21-11-4-12-22-36;1-3-14-31(15-4-1)42-48-43(32-16-5-2-6-17-32)50-44(49-42)33-22-23-38(46-28-33)39-26-34(36-21-11-18-29-12-7-9-19-35(29)36)27-40(47-39)41-37-20-10-8-13-30(37)24-25-45-41/h1-31H;1-32H;1-28H
InChIKeyDMDZXRNCGZBQES-UHFFFAOYSA-N
MW2039.40 g/mol
LogP32.91
Rot. Bonds21

About 2-[6-[4-(3,5-diphenylphenyl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]-4,6-diphenyl-1,3,5-triazine;1-[6-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-4-naphthalen-1-yl-2-pyridinyl]isoquinoline;9-[3-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]carbazole

2-[6-[4-(3,5-diphenylphenyl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]-4,6-diphenyl-1,3,5-triazine;1-[6-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-4-naphthalen-1-yl-2-pyridinyl]isoquinoline;9-[3-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]carbazole (PubChem CID 164973724) has the molecular formula C140H91N19 and a molecular weight of 2039.40 g/mol. Its IUPAC name is 2-[6-[4-(3,5-diphenylphenyl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]-4,6-diphenyl-1,3,5-triazine;1-[6-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-4-naphthalen-1-yl-2-pyridinyl]isoquinoline;9-[3-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]carbazole.

Molecular Properties

Compound Name2-[6-[4-(3,5-diphenylphenyl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]-4,6-diphenyl-1,3,5-triazine;1-[6-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-4-naphthalen-1-yl-2-pyridinyl]isoquinoline;9-[3-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]carbazole
PubChem CID164973724
Molecular FormulaC140H91N19
Molecular Weight2039.40 g/mol
Exact Mass2037.77
IUPAC Name2-[6-[4-(3,5-diphenylphenyl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]-4,6-diphenyl-1,3,5-triazine;1-[6-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-4-naphthalen-1-yl-2-pyridinyl]isoquinoline;9-[3-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3cc(-c4ccccn4)nc(-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cn4)c3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cc(-c5cccc(-n6c7ccccc7c7ccccc76)c5)cc(-c5ccccn5)n4)nc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cc(-c5cccc6ccccc56)cc(-c5nccc6ccccc56)n4)nc3)n2)cc1
InChIInChI=1S/C48H31N7.C48H32N6.C44H28N6/c1-3-14-32(15-4-1)46-52-47(33-16-5-2-6-17-33)54-48(53-46)35-25-26-41(50-31-35)43-30-36(29-42(51-43)40-22-11-12-27-49-40)34-18-13-19-37(28-34)55-44-23-9-7-20-38(44)39-21-8-10-24-45(39)55;1-5-15-33(16-6-1)38-27-39(34-17-7-2-8-18-34)29-40(28-38)41-30-44(42-23-13-14-26-49-42)51-45(31-41)43-25-24-37(32-50-43)48-53-46(35-19-9-3-10-20-35)52-47(54-48)36-21-11-4-12-22-36;1-3-14-31(15-4-1)42-48-43(32-16-5-2-6-17-32)50-44(49-42)33-22-23-38(46-28-33)39-26-34(36-21-11-18-29-12-7-9-19-35(29)36)27-40(47-39)41-37-20-10-8-13-30(37)24-25-45-41/h1-31H;1-32H;1-28H
InChIKeyDMDZXRNCGZBQES-UHFFFAOYSA-N
XLogP32.91
TPSA236.95 Ų
H-Bond Donors
H-Bond Acceptors19
Rotatable Bonds21
Heavy Atoms159
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002039.40
LogP ≤ 532.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1019

Analyze 2-[6-[4-(3,5-diphenylphenyl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]-4,6-diphenyl-1,3,5-triazine;1-[6-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-4-naphthalen-1-yl-2-pyridinyl]isoquinoline;9-[3-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[6-[4-(3,5-diphenylphenyl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]-4,6-diphenyl-1,3,5-triazine;1-[6-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-4-naphthalen-1-yl-2-pyridinyl]isoquinoline;9-[3-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]carbazole?
The IUPAC name of 2-[6-[4-(3,5-diphenylphenyl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]-4,6-diphenyl-1,3,5-triazine;1-[6-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-4-naphthalen-1-yl-2-pyridinyl]isoquinoline;9-[3-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]carbazole (CID 164973724) is 2-[6-[4-(3,5-diphenylphenyl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]-4,6-diphenyl-1,3,5-triazine;1-[6-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-4-naphthalen-1-yl-2-pyridinyl]isoquinoline;9-[3-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]carbazole.
What is the SMILES notation for 2-[6-[4-(3,5-diphenylphenyl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]-4,6-diphenyl-1,3,5-triazine;1-[6-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-4-naphthalen-1-yl-2-pyridinyl]isoquinoline;9-[3-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]carbazole?
The canonical SMILES for 2-[6-[4-(3,5-diphenylphenyl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]-4,6-diphenyl-1,3,5-triazine;1-[6-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-4-naphthalen-1-yl-2-pyridinyl]isoquinoline;9-[3-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]carbazole is c1ccc(-c2cc(-c3ccccc3)cc(-c3cc(-c4ccccn4)nc(-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cn4)c3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cc(-c5cccc(-n6c7ccccc7c7ccccc76)c5)cc(-c5ccccn5)n4)nc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cc(-c5cccc6ccccc56)cc(-c5nccc6ccccc56)n4)nc3)n2)cc1.
What is the InChIKey of 2-[6-[4-(3,5-diphenylphenyl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]-4,6-diphenyl-1,3,5-triazine;1-[6-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-4-naphthalen-1-yl-2-pyridinyl]isoquinoline;9-[3-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]carbazole?
The InChIKey is DMDZXRNCGZBQES-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H31N7.C48H32N6.C44H28N6/c1-3-14-32(15-4-1)46-52-47(33-16-5-2-6-17-33)54-48(53-46)35-25-26-41(50-31-35)43-30-36(29-42(51-43)40-22-11-12-27-49-40)34-18-13-19-37(28-34)55-44-23-9-7-20-38(44)39-21-8-10-24-45(39)55;1-5-15-33(16-6-1)38-27-39(34-17-7-2-8-18-34)29-40(28-38)41-30-44(42-23-13-14-26-49-42)51-45(31-41)43-25-24-37(32-50-43)48-53-46(35-19-9-3-10-20-35)52-47(54-48)36-21-11-4-12-22-36;1-3-14-31(15-4-1)42-48-43(32-16-5-2-6-17-32)50-44(49-42)33-22-23-38(46-28-33)39-26-34(36-21-11-18-29-12-7-9-19-35(29)36)27-40(47-39)41-37-20-10-8-13-30(37)24-25-45-41/h1-31H;1-32H;1-28H.
What are the key properties of 2-[6-[4-(3,5-diphenylphenyl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]-4,6-diphenyl-1,3,5-triazine;1-[6-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-4-naphthalen-1-yl-2-pyridinyl]isoquinoline;9-[3-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]carbazole?
2-[6-[4-(3,5-diphenylphenyl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]-4,6-diphenyl-1,3,5-triazine;1-[6-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-4-naphthalen-1-yl-2-pyridinyl]isoquinoline;9-[3-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]carbazole has a molecular weight of 2039.40 g/mol, XLogP of 32.91, 21 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[4-(3,5-diphenylphenyl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]-4,6-diphenyl-1,3,5-triazine;1-[6-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-4-naphthalen-1-yl-2-pyridinyl]isoquinoline;9-[3-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]carbazole is sourced from PubChem (CID 164973724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).