2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzothiazole;2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzoxazole;2-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-1,3-benzoxazole;2-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-1,3-benzoxazole;1-[4-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]phenyl]-2-phenylbenzimidazole;1-[4-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]phenyl]-2-phenylbenzimidazole

C288H186N38O3S — CID 157316716

IUPAC2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzothiazole;2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzoxazole;2-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-1,3-benzoxazole;2-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-1,3-benzoxazole;1-[4-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]phenyl]-2-phenylbenzimidazole;1-[4-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]phenyl]-2-phenylbenzimidazole
SMILESc1ccc(-c2cc(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)c3)nc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)n2)cc1.c1ccc(-c2cc(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)c3)nc(-c3nc4ccccc4o3)n2)cc1.c1ccc(-c2cc(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6nc7ccccc7o6)n5)c4)c3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6nc7ccccc7s6)n5)c4)c3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)cc(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)c3)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)c3)cc(-c3nc4ccccc4o3)n2)cc1
InChIInChI=1S/2C56H37N7.3C44H28N6O.C44H28N6S/c1-5-17-39(18-6-1)52-57-49(38-31-33-47(34-32-38)63-51-30-14-13-29-48(51)59-56(63)42-23-11-4-12-24-42)37-50(58-52)45-27-15-25-43(35-45)44-26-16-28-46(36-44)55-61-53(40-19-7-2-8-20-40)60-54(62-55)41-21-9-3-10-22-41;1-5-17-38(18-6-1)49-37-50(58-52(57-49)41-31-33-47(34-32-41)63-51-30-14-13-29-48(51)59-56(63)42-23-11-4-12-24-42)45-27-15-25-43(35-45)44-26-16-28-46(36-44)55-61-53(39-19-7-2-8-20-39)60-54(62-55)40-21-9-3-10-22-40;1-4-14-29(15-5-1)40-45-37(28-38(46-40)44-47-36-24-10-11-25-39(36)51-44)34-22-12-20-32(26-34)33-21-13-23-35(27-33)43-49-41(30-16-6-2-7-17-30)48-42(50-43)31-18-8-3-9-19-31;1-4-14-29(15-5-1)37-28-38(46-43(45-37)44-47-36-24-10-11-25-39(36)51-44)34-22-12-20-32(26-34)33-21-13-23-35(27-33)42-49-40(30-16-6-2-7-17-30)48-41(50-42)31-18-8-3-9-19-31;2*1-4-14-29(15-5-1)37-28-38(46-40(45-37)30-16-6-2-7-17-30)34-22-12-20-32(26-34)33-21-13-23-35(27-33)42-48-41(31-18-8-3-9-19-31)49-43(50-42)44-47-36-24-10-11-25-39(36)51-44/h2*1-37H;4*1-28H
InChIKeyBDRIELMTOSGKMY-UHFFFAOYSA-N
MW4258.99 g/mol
LogP69.03
Rot. Bonds46

About 2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzothiazole;2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzoxazole;2-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-1,3-benzoxazole;2-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-1,3-benzoxazole;1-[4-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]phenyl]-2-phenylbenzimidazole;1-[4-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]phenyl]-2-phenylbenzimidazole

2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzothiazole;2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzoxazole;2-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-1,3-benzoxazole;2-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-1,3-benzoxazole;1-[4-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]phenyl]-2-phenylbenzimidazole;1-[4-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]phenyl]-2-phenylbenzimidazole (PubChem CID 157316716) has the molecular formula C288H186N38O3S and a molecular weight of 4258.99 g/mol. Its IUPAC name is 2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzothiazole;2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzoxazole;2-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-1,3-benzoxazole;2-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-1,3-benzoxazole;1-[4-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]phenyl]-2-phenylbenzimidazole;1-[4-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]phenyl]-2-phenylbenzimidazole.

Molecular Properties

Compound Name2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzothiazole;2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzoxazole;2-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-1,3-benzoxazole;2-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-1,3-benzoxazole;1-[4-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]phenyl]-2-phenylbenzimidazole;1-[4-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]phenyl]-2-phenylbenzimidazole
PubChem CID157316716
Molecular FormulaC288H186N38O3S
Molecular Weight4258.99 g/mol
Exact Mass4255.53
IUPAC Name2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzothiazole;2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzoxazole;2-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-1,3-benzoxazole;2-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-1,3-benzoxazole;1-[4-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]phenyl]-2-phenylbenzimidazole;1-[4-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]phenyl]-2-phenylbenzimidazole
SMILESc1ccc(-c2cc(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)c3)nc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)n2)cc1.c1ccc(-c2cc(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)c3)nc(-c3nc4ccccc4o3)n2)cc1.c1ccc(-c2cc(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6nc7ccccc7o6)n5)c4)c3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6nc7ccccc7s6)n5)c4)c3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)cc(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)c3)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)c3)cc(-c3nc4ccccc4o3)n2)cc1
InChIInChI=1S/2C56H37N7.3C44H28N6O.C44H28N6S/c1-5-17-39(18-6-1)52-57-49(38-31-33-47(34-32-38)63-51-30-14-13-29-48(51)59-56(63)42-23-11-4-12-24-42)37-50(58-52)45-27-15-25-43(35-45)44-26-16-28-46(36-44)55-61-53(40-19-7-2-8-20-40)60-54(62-55)41-21-9-3-10-22-41;1-5-17-38(18-6-1)49-37-50(58-52(57-49)41-31-33-47(34-32-41)63-51-30-14-13-29-48(51)59-56(63)42-23-11-4-12-24-42)45-27-15-25-43(35-45)44-26-16-28-46(36-44)55-61-53(39-19-7-2-8-20-39)60-54(62-55)40-21-9-3-10-22-40;1-4-14-29(15-5-1)40-45-37(28-38(46-40)44-47-36-24-10-11-25-39(36)51-44)34-22-12-20-32(26-34)33-21-13-23-35(27-33)43-49-41(30-16-6-2-7-17-30)48-42(50-43)31-18-8-3-9-19-31;1-4-14-29(15-5-1)37-28-38(46-43(45-37)44-47-36-24-10-11-25-39(36)51-44)34-22-12-20-32(26-34)33-21-13-23-35(27-33)42-49-40(30-16-6-2-7-17-30)48-41(50-42)31-18-8-3-9-19-31;2*1-4-14-29(15-5-1)37-28-38(46-40(45-37)30-16-6-2-7-17-30)34-22-12-20-32(26-34)33-21-13-23-35(27-33)42-48-41(31-18-8-3-9-19-31)49-43(50-42)44-47-36-24-10-11-25-39(36)51-44/h2*1-37H;4*1-28H
InChIKeyBDRIELMTOSGKMY-UHFFFAOYSA-N
XLogP69.03
TPSA513.32 Ų
H-Bond Donors
H-Bond Acceptors42
Rotatable Bonds46
Heavy Atoms330
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004258.99
LogP ≤ 569.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1042

Analyze 2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzothiazole;2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzoxazole;2-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-1,3-benzoxazole;2-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-1,3-benzoxazole;1-[4-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]phenyl]-2-phenylbenzimidazole;1-[4-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]phenyl]-2-phenylbenzimidazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzothiazole;2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzoxazole;2-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-1,3-benzoxazole;2-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-1,3-benzoxazole;1-[4-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]phenyl]-2-phenylbenzimidazole;1-[4-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]phenyl]-2-phenylbenzimidazole?
The IUPAC name of 2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzothiazole;2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzoxazole;2-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-1,3-benzoxazole;2-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-1,3-benzoxazole;1-[4-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]phenyl]-2-phenylbenzimidazole;1-[4-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]phenyl]-2-phenylbenzimidazole (CID 157316716) is 2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzothiazole;2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzoxazole;2-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-1,3-benzoxazole;2-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-1,3-benzoxazole;1-[4-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]phenyl]-2-phenylbenzimidazole;1-[4-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]phenyl]-2-phenylbenzimidazole.
What is the SMILES notation for 2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzothiazole;2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzoxazole;2-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-1,3-benzoxazole;2-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-1,3-benzoxazole;1-[4-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]phenyl]-2-phenylbenzimidazole;1-[4-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]phenyl]-2-phenylbenzimidazole?
The canonical SMILES for 2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzothiazole;2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzoxazole;2-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-1,3-benzoxazole;2-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-1,3-benzoxazole;1-[4-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]phenyl]-2-phenylbenzimidazole;1-[4-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]phenyl]-2-phenylbenzimidazole is c1ccc(-c2cc(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)c3)nc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)n2)cc1.c1ccc(-c2cc(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)c3)nc(-c3nc4ccccc4o3)n2)cc1.c1ccc(-c2cc(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6nc7ccccc7o6)n5)c4)c3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6nc7ccccc7s6)n5)c4)c3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)cc(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)c3)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)c3)cc(-c3nc4ccccc4o3)n2)cc1.
What is the InChIKey of 2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzothiazole;2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzoxazole;2-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-1,3-benzoxazole;2-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-1,3-benzoxazole;1-[4-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]phenyl]-2-phenylbenzimidazole;1-[4-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]phenyl]-2-phenylbenzimidazole?
The InChIKey is BDRIELMTOSGKMY-UHFFFAOYSA-N. The full InChI is InChI=1S/2C56H37N7.3C44H28N6O.C44H28N6S/c1-5-17-39(18-6-1)52-57-49(38-31-33-47(34-32-38)63-51-30-14-13-29-48(51)59-56(63)42-23-11-4-12-24-42)37-50(58-52)45-27-15-25-43(35-45)44-26-16-28-46(36-44)55-61-53(40-19-7-2-8-20-40)60-54(62-55)41-21-9-3-10-22-41;1-5-17-38(18-6-1)49-37-50(58-52(57-49)41-31-33-47(34-32-41)63-51-30-14-13-29-48(51)59-56(63)42-23-11-4-12-24-42)45-27-15-25-43(35-45)44-26-16-28-46(36-44)55-61-53(39-19-7-2-8-20-39)60-54(62-55)40-21-9-3-10-22-40;1-4-14-29(15-5-1)40-45-37(28-38(46-40)44-47-36-24-10-11-25-39(36)51-44)34-22-12-20-32(26-34)33-21-13-23-35(27-33)43-49-41(30-16-6-2-7-17-30)48-42(50-43)31-18-8-3-9-19-31;1-4-14-29(15-5-1)37-28-38(46-43(45-37)44-47-36-24-10-11-25-39(36)51-44)34-22-12-20-32(26-34)33-21-13-23-35(27-33)42-49-40(30-16-6-2-7-17-30)48-41(50-42)31-18-8-3-9-19-31;2*1-4-14-29(15-5-1)37-28-38(46-40(45-37)30-16-6-2-7-17-30)34-22-12-20-32(26-34)33-21-13-23-35(27-33)42-48-41(31-18-8-3-9-19-31)49-43(50-42)44-47-36-24-10-11-25-39(36)51-44/h2*1-37H;4*1-28H.
What are the key properties of 2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzothiazole;2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzoxazole;2-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-1,3-benzoxazole;2-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-1,3-benzoxazole;1-[4-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]phenyl]-2-phenylbenzimidazole;1-[4-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]phenyl]-2-phenylbenzimidazole?
2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzothiazole;2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzoxazole;2-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-1,3-benzoxazole;2-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-1,3-benzoxazole;1-[4-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]phenyl]-2-phenylbenzimidazole;1-[4-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]phenyl]-2-phenylbenzimidazole has a molecular weight of 4258.99 g/mol, XLogP of 69.03, 46 rotatable bonds, 0 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzothiazole;2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzoxazole;2-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-1,3-benzoxazole;2-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-1,3-benzoxazole;1-[4-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]phenyl]-2-phenylbenzimidazole;1-[4-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]phenyl]-2-phenylbenzimidazole is sourced from PubChem (CID 157316716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).