2-[4-[4-(6-tert-butylnaphthalen-1-yl)-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole;1-[4-[4-naphthalen-2-yl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[4-[4-[4-(2-phenylbenzimidazol-1-yl)phenyl]-6-(4-propan-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]-6-[4-(3,4,5-trimethylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-phenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;2-phenyl-1-[4-[4-phenyl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole

C306H214N42 — CID 162013546

IUPAC2-[4-[4-(6-tert-butylnaphthalen-1-yl)-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole;1-[4-[4-naphthalen-2-yl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[4-[4-[4-(2-phenylbenzimidazol-1-yl)phenyl]-6-(4-propan-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]-6-[4-(3,4,5-trimethylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-phenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;2-phenyl-1-[4-[4-phenyl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole
SMILESCC(C)(C)c1ccc2c(-c3nc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)nc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)n3)cccc2c1.CC(C)c1ccc(-c2nc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)nc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)n2)cc1.Cc1cc(-c2ccc(-c3nc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)nc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)n3)cc2)cc(C)c1C.c1ccc(-c2nc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)nc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)n2)cc1.c1ccc(-c2nc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)nc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)n2)cc1.c1ccc(-c2nc3ccccc3n2-c2ccc(-c3nc(-c4ccc(-n5c(-c6ccccc6)nc6ccccc65)cc4)nc(-c4ccc5ccccc5c4)n3)cc2)cc1
InChIInChI=1S/C56H41N7.C55H41N7.C51H33N7.C50H37N7.2C47H31N7/c1-36-34-45(35-37(2)38(36)3)39-22-24-40(25-23-39)52-59-53(41-26-30-43(31-27-41)55-57-48-18-10-12-20-50(48)62(55)46-14-6-4-7-15-46)61-54(60-52)42-28-32-44(33-29-42)56-58-49-19-11-13-21-51(49)63(56)47-16-8-5-9-17-47;1-55(2,3)41-33-34-44-40(35-41)15-14-20-45(44)52-59-50(36-25-29-38(30-26-36)53-56-46-21-10-12-23-48(46)61(53)42-16-6-4-7-17-42)58-51(60-52)37-27-31-39(32-28-37)54-57-47-22-11-13-24-49(47)62(54)43-18-8-5-9-19-43;1-3-14-37(15-4-1)50-52-43-19-9-11-21-45(43)57(50)41-29-25-35(26-30-41)47-54-48(56-49(55-47)40-24-23-34-13-7-8-18-39(34)33-40)36-27-31-42(32-28-36)58-46-22-12-10-20-44(46)53-51(58)38-16-5-2-6-17-38;1-33(2)34-21-23-35(24-22-34)46-53-47(36-25-29-40(30-26-36)56-44-19-11-9-17-42(44)51-49(56)38-13-5-3-6-14-38)55-48(54-46)37-27-31-41(32-28-37)57-45-20-12-10-18-43(45)52-50(57)39-15-7-4-8-16-39;1-4-14-32(15-5-1)43-50-44(33-24-28-35(29-25-33)46-48-39-20-10-12-22-41(39)53(46)37-16-6-2-7-17-37)52-45(51-43)34-26-30-36(31-27-34)47-49-40-21-11-13-23-42(40)54(47)38-18-8-3-9-19-38;1-4-14-32(15-5-1)43-50-44(33-24-28-37(29-25-33)53-41-22-12-10-20-39(41)48-46(53)35-16-6-2-7-17-35)52-45(51-43)34-26-30-38(31-27-34)54-42-23-13-11-21-40(42)49-47(54)36-18-8-3-9-19-36/h4-35H,1-3H3;4-35H,1-3H3;1-33H;3-33H,1-2H3;2*1-31H
InChIKeyYTUKZEPUBRGTRD-UHFFFAOYSA-N
MW4479.37 g/mol
LogP72.63
Rot. Bonds44

About 2-[4-[4-(6-tert-butylnaphthalen-1-yl)-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole;1-[4-[4-naphthalen-2-yl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[4-[4-[4-(2-phenylbenzimidazol-1-yl)phenyl]-6-(4-propan-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]-6-[4-(3,4,5-trimethylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-phenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;2-phenyl-1-[4-[4-phenyl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole

2-[4-[4-(6-tert-butylnaphthalen-1-yl)-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole;1-[4-[4-naphthalen-2-yl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[4-[4-[4-(2-phenylbenzimidazol-1-yl)phenyl]-6-(4-propan-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]-6-[4-(3,4,5-trimethylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-phenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;2-phenyl-1-[4-[4-phenyl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole (PubChem CID 162013546) has the molecular formula C306H214N42 and a molecular weight of 4479.37 g/mol. Its IUPAC name is 2-[4-[4-(6-tert-butylnaphthalen-1-yl)-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole;1-[4-[4-naphthalen-2-yl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[4-[4-[4-(2-phenylbenzimidazol-1-yl)phenyl]-6-(4-propan-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]-6-[4-(3,4,5-trimethylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-phenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;2-phenyl-1-[4-[4-phenyl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole.

Molecular Properties

Compound Name2-[4-[4-(6-tert-butylnaphthalen-1-yl)-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole;1-[4-[4-naphthalen-2-yl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[4-[4-[4-(2-phenylbenzimidazol-1-yl)phenyl]-6-(4-propan-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]-6-[4-(3,4,5-trimethylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-phenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;2-phenyl-1-[4-[4-phenyl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole
PubChem CID162013546
Molecular FormulaC306H214N42
Molecular Weight4479.37 g/mol
Exact Mass4475.80
IUPAC Name2-[4-[4-(6-tert-butylnaphthalen-1-yl)-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole;1-[4-[4-naphthalen-2-yl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[4-[4-[4-(2-phenylbenzimidazol-1-yl)phenyl]-6-(4-propan-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]-6-[4-(3,4,5-trimethylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-phenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;2-phenyl-1-[4-[4-phenyl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole
SMILESCC(C)(C)c1ccc2c(-c3nc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)nc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)n3)cccc2c1.CC(C)c1ccc(-c2nc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)nc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)n2)cc1.Cc1cc(-c2ccc(-c3nc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)nc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)n3)cc2)cc(C)c1C.c1ccc(-c2nc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)nc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)n2)cc1.c1ccc(-c2nc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)nc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)n2)cc1.c1ccc(-c2nc3ccccc3n2-c2ccc(-c3nc(-c4ccc(-n5c(-c6ccccc6)nc6ccccc65)cc4)nc(-c4ccc5ccccc5c4)n3)cc2)cc1
InChIInChI=1S/C56H41N7.C55H41N7.C51H33N7.C50H37N7.2C47H31N7/c1-36-34-45(35-37(2)38(36)3)39-22-24-40(25-23-39)52-59-53(41-26-30-43(31-27-41)55-57-48-18-10-12-20-50(48)62(55)46-14-6-4-7-15-46)61-54(60-52)42-28-32-44(33-29-42)56-58-49-19-11-13-21-51(49)63(56)47-16-8-5-9-17-47;1-55(2,3)41-33-34-44-40(35-41)15-14-20-45(44)52-59-50(36-25-29-38(30-26-36)53-56-46-21-10-12-23-48(46)61(53)42-16-6-4-7-17-42)58-51(60-52)37-27-31-39(32-28-37)54-57-47-22-11-13-24-49(47)62(54)43-18-8-5-9-19-43;1-3-14-37(15-4-1)50-52-43-19-9-11-21-45(43)57(50)41-29-25-35(26-30-41)47-54-48(56-49(55-47)40-24-23-34-13-7-8-18-39(34)33-40)36-27-31-42(32-28-36)58-46-22-12-10-20-44(46)53-51(58)38-16-5-2-6-17-38;1-33(2)34-21-23-35(24-22-34)46-53-47(36-25-29-40(30-26-36)56-44-19-11-9-17-42(44)51-49(56)38-13-5-3-6-14-38)55-48(54-46)37-27-31-41(32-28-37)57-45-20-12-10-18-43(45)52-50(57)39-15-7-4-8-16-39;1-4-14-32(15-5-1)43-50-44(33-24-28-35(29-25-33)46-48-39-20-10-12-22-41(39)53(46)37-16-6-2-7-17-37)52-45(51-43)34-26-30-36(31-27-34)47-49-40-21-11-13-23-42(40)54(47)38-18-8-3-9-19-38;1-4-14-32(15-5-1)43-50-44(33-24-28-37(29-25-33)53-41-22-12-10-20-39(41)48-46(53)35-16-6-2-7-17-35)52-45(51-43)34-26-30-38(31-27-34)54-42-23-13-11-21-40(42)49-47(54)36-18-8-3-9-19-36/h4-35H,1-3H3;4-35H,1-3H3;1-33H;3-33H,1-2H3;2*1-31H
InChIKeyYTUKZEPUBRGTRD-UHFFFAOYSA-N
XLogP72.63
TPSA445.86 Ų
H-Bond Donors
H-Bond Acceptors42
Rotatable Bonds44
Heavy Atoms348
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004479.37
LogP ≤ 572.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1042

Analyze 2-[4-[4-(6-tert-butylnaphthalen-1-yl)-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole;1-[4-[4-naphthalen-2-yl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[4-[4-[4-(2-phenylbenzimidazol-1-yl)phenyl]-6-(4-propan-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]-6-[4-(3,4,5-trimethylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-phenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;2-phenyl-1-[4-[4-phenyl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole with MolForge

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Related Compounds

1-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(4-propan-2-ylphenyl)benzimidazol-1-yl]phenyl]-2-(4-propan-2-ylphenyl)benzimidazole
CID 155173829
2-(4-deuteriophenyl)-1-[4-(4,6-dinaphthalen-2-yl-2-pyridinyl)phenyl]benzimidazole;2-(4-deuteriophenyl)-1-[4-(4,6-diphenyl-2-pyridinyl)phenyl]benzimidazole;1-[4-[4,6-di(phenanthren-9-yl)-1,3,5-triazin-2-yl]phenyl]-2-(4-methylphenyl)benzimidazole
CID 157091418
2-[3,5-bis(1-phenylbenzimidazol-2-yl)phenyl]-1-phenylbenzimidazole;2-tert-butyl-9,10-dinaphthalen-2-ylanthracene;9-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[3,5-di(carbazol-9-yl)phenyl]carbazole;9,10-dinaphthalen-2-ylanthracene
CID 159092150
3,6-ditert-butyl-9-[4-(2-phenylbenzimidazol-1-yl)phenyl]carbazole
CID 102188971
1-[4-[4,6-bis[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole
CID 152919581
2-tert-butyl-9-(4-phenylphenyl)-7-[9-(4-propan-2-ylphenyl)carbazol-2-yl]carbazole
CID 134419811
1-[4-[10-[3-[3-[5-[10-[4-(2-methylbenzimidazol-1-yl)phenyl]anthracen-9-yl]naphthalen-2-yl]phenyl]-5-phenylphenyl]anthracen-9-yl]phenyl]-2-phenylbenzimidazole
CID 139519929
1-[4-(9,10-diphenyl-6-propan-2-ylanthracen-2-yl)phenyl]-2-phenylbenzimidazole
CID 58953696
2-[4-[9,10-bis(2-phenylphenyl)anthracen-2-yl]phenyl]-1-phenylbenzimidazole;2-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)phenyl]-1-phenylbenzimidazole;2-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-1-phenylbenzimidazole;2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-1-phenylbenzimidazole
CID 159805058
2-phenyl-1-(4-pyren-2-ylphenyl)benzimidazole
CID 90362549
1-[4-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)phenyl]-2-naphthalen-2-ylbenzimidazole;1-[4-[4,6-di(phenanthren-9-yl)pyrimidin-2-yl]phenyl]-2-naphthalen-2-ylbenzimidazole;1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-2-naphthalen-2-ylbenzimidazole
CID 159325924
4-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine
CID 162128056

Frequently Asked Questions

What is the IUPAC name of 2-[4-[4-(6-tert-butylnaphthalen-1-yl)-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole;1-[4-[4-naphthalen-2-yl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[4-[4-[4-(2-phenylbenzimidazol-1-yl)phenyl]-6-(4-propan-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]-6-[4-(3,4,5-trimethylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-phenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;2-phenyl-1-[4-[4-phenyl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole?
The IUPAC name of 2-[4-[4-(6-tert-butylnaphthalen-1-yl)-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole;1-[4-[4-naphthalen-2-yl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[4-[4-[4-(2-phenylbenzimidazol-1-yl)phenyl]-6-(4-propan-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]-6-[4-(3,4,5-trimethylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-phenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;2-phenyl-1-[4-[4-phenyl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole (CID 162013546) is 2-[4-[4-(6-tert-butylnaphthalen-1-yl)-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole;1-[4-[4-naphthalen-2-yl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[4-[4-[4-(2-phenylbenzimidazol-1-yl)phenyl]-6-(4-propan-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]-6-[4-(3,4,5-trimethylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-phenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;2-phenyl-1-[4-[4-phenyl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole.
What is the SMILES notation for 2-[4-[4-(6-tert-butylnaphthalen-1-yl)-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole;1-[4-[4-naphthalen-2-yl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[4-[4-[4-(2-phenylbenzimidazol-1-yl)phenyl]-6-(4-propan-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]-6-[4-(3,4,5-trimethylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-phenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;2-phenyl-1-[4-[4-phenyl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole?
The canonical SMILES for 2-[4-[4-(6-tert-butylnaphthalen-1-yl)-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole;1-[4-[4-naphthalen-2-yl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[4-[4-[4-(2-phenylbenzimidazol-1-yl)phenyl]-6-(4-propan-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]-6-[4-(3,4,5-trimethylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-phenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;2-phenyl-1-[4-[4-phenyl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole is CC(C)(C)c1ccc2c(-c3nc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)nc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)n3)cccc2c1.CC(C)c1ccc(-c2nc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)nc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)n2)cc1.Cc1cc(-c2ccc(-c3nc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)nc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)n3)cc2)cc(C)c1C.c1ccc(-c2nc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)nc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)n2)cc1.c1ccc(-c2nc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)nc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)n2)cc1.c1ccc(-c2nc3ccccc3n2-c2ccc(-c3nc(-c4ccc(-n5c(-c6ccccc6)nc6ccccc65)cc4)nc(-c4ccc5ccccc5c4)n3)cc2)cc1.
What is the InChIKey of 2-[4-[4-(6-tert-butylnaphthalen-1-yl)-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole;1-[4-[4-naphthalen-2-yl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[4-[4-[4-(2-phenylbenzimidazol-1-yl)phenyl]-6-(4-propan-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]-6-[4-(3,4,5-trimethylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-phenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;2-phenyl-1-[4-[4-phenyl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole?
The InChIKey is YTUKZEPUBRGTRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H41N7.C55H41N7.C51H33N7.C50H37N7.2C47H31N7/c1-36-34-45(35-37(2)38(36)3)39-22-24-40(25-23-39)52-59-53(41-26-30-43(31-27-41)55-57-48-18-10-12-20-50(48)62(55)46-14-6-4-7-15-46)61-54(60-52)42-28-32-44(33-29-42)56-58-49-19-11-13-21-51(49)63(56)47-16-8-5-9-17-47;1-55(2,3)41-33-34-44-40(35-41)15-14-20-45(44)52-59-50(36-25-29-38(30-26-36)53-56-46-21-10-12-23-48(46)61(53)42-16-6-4-7-17-42)58-51(60-52)37-27-31-39(32-28-37)54-57-47-22-11-13-24-49(47)62(54)43-18-8-5-9-19-43;1-3-14-37(15-4-1)50-52-43-19-9-11-21-45(43)57(50)41-29-25-35(26-30-41)47-54-48(56-49(55-47)40-24-23-34-13-7-8-18-39(34)33-40)36-27-31-42(32-28-36)58-46-22-12-10-20-44(46)53-51(58)38-16-5-2-6-17-38;1-33(2)34-21-23-35(24-22-34)46-53-47(36-25-29-40(30-26-36)56-44-19-11-9-17-42(44)51-49(56)38-13-5-3-6-14-38)55-48(54-46)37-27-31-41(32-28-37)57-45-20-12-10-18-43(45)52-50(57)39-15-7-4-8-16-39;1-4-14-32(15-5-1)43-50-44(33-24-28-35(29-25-33)46-48-39-20-10-12-22-41(39)53(46)37-16-6-2-7-17-37)52-45(51-43)34-26-30-36(31-27-34)47-49-40-21-11-13-23-42(40)54(47)38-18-8-3-9-19-38;1-4-14-32(15-5-1)43-50-44(33-24-28-37(29-25-33)53-41-22-12-10-20-39(41)48-46(53)35-16-6-2-7-17-35)52-45(51-43)34-26-30-38(31-27-34)54-42-23-13-11-21-40(42)49-47(54)36-18-8-3-9-19-36/h4-35H,1-3H3;4-35H,1-3H3;1-33H;3-33H,1-2H3;2*1-31H.
What are the key properties of 2-[4-[4-(6-tert-butylnaphthalen-1-yl)-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole;1-[4-[4-naphthalen-2-yl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[4-[4-[4-(2-phenylbenzimidazol-1-yl)phenyl]-6-(4-propan-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]-6-[4-(3,4,5-trimethylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-phenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;2-phenyl-1-[4-[4-phenyl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole?
2-[4-[4-(6-tert-butylnaphthalen-1-yl)-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole;1-[4-[4-naphthalen-2-yl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[4-[4-[4-(2-phenylbenzimidazol-1-yl)phenyl]-6-(4-propan-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]-6-[4-(3,4,5-trimethylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-phenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;2-phenyl-1-[4-[4-phenyl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole has a molecular weight of 4479.37 g/mol, XLogP of 72.63, 44 rotatable bonds, 0 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[4-(6-tert-butylnaphthalen-1-yl)-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole;1-[4-[4-naphthalen-2-yl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[4-[4-[4-(2-phenylbenzimidazol-1-yl)phenyl]-6-(4-propan-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]-6-[4-(3,4,5-trimethylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-[4-phenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole;2-phenyl-1-[4-[4-phenyl-6-[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole is sourced from PubChem (CID 162013546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).