2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-4,6-diphenylpyrimidine;4-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;4-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;5-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2-octylpyrimidine;4-[3,5-bis[3-(2-methylphenyl)phenyl]phenyl]-2-phenyl-6-pyridin-2-ylpyrimidine;2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-5-phenylpyrimidine;4-[3-(3-methylphenyl)phenyl]-6-[3-[3-(3-methylphenyl)phenyl]phenyl]-2-phenylpyrimidine

C366H286N18 — CID 159501503

IUPAC2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-4,6-diphenylpyrimidine;4-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;4-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;5-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2-octylpyrimidine;4-[3,5-bis[3-(2-methylphenyl)phenyl]phenyl]-2-phenyl-6-pyridin-2-ylpyrimidine;2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-5-phenylpyrimidine;4-[3-(3-methylphenyl)phenyl]-6-[3-[3-(3-methylphenyl)phenyl]phenyl]-2-phenylpyrimidine
SMILESCCCCCCCCc1ncc(-c2cc(-c3cccc(-c4ccc(C)cc4)c3)cc(-c3cccc(-c4ccc(C)cc4)c3)c2)cn1.Cc1ccc(-c2cccc(-c3cc(-c4cccc(-c5ccc(C)cc5)c4)cc(-c4cc(-c5ccccc5)nc(-c5ccccc5)n4)c3)c2)cc1.Cc1ccc(-c2cccc(-c3cc(-c4cccc(-c5ccc(C)cc5)c4)cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)c2)cc1.Cc1cccc(-c2cccc(-c3cc(-c4cccc(-c5cccc(C)c5)c4)cc(-c4cc(-c5ccccc5)nc(-c5ccccc5)n4)c3)c2)c1.Cc1cccc(-c2cccc(-c3cc(-c4cccc(-c5cccc(C)c5)c4)cc(-c4nc(-c5ccccc5)cc(-c5ccccc5)n4)c3)c2)c1.Cc1cccc(-c2cccc(-c3cc(-c4cccc(-c5cccc(C)c5)c4)cc(-c4ncc(-c5ccccc5)cn4)c3)c2)c1.Cc1cccc(-c2cccc(-c3cccc(-c4cc(-c5cccc(-c6cccc(C)c6)c5)nc(-c5ccccc5)n4)c3)c2)c1.Cc1ccccc1-c1cccc(-c2cc(-c3cccc(-c4ccccc4C)c3)cc(-c3cc(-c4ccccn4)nc(-c4ccccc4)n3)c2)c1
InChIInChI=1S/3C48H36N2.2C47H35N3.C44H44N2.2C42H32N2/c1-33-13-9-19-37(25-33)39-21-11-23-41(27-39)43-29-44(42-24-12-22-40(28-42)38-20-10-14-34(2)26-38)31-45(30-43)47-32-46(35-15-5-3-6-16-35)49-48(50-47)36-17-7-4-8-18-36;1-33-13-9-19-37(25-33)39-21-11-23-41(27-39)43-29-44(42-24-12-22-40(28-42)38-20-10-14-34(2)26-38)31-45(30-43)48-49-46(35-15-5-3-6-16-35)32-47(50-48)36-17-7-4-8-18-36;1-33-19-23-35(24-20-33)39-15-9-17-41(27-39)43-29-44(42-18-10-16-40(28-42)36-25-21-34(2)22-26-36)31-45(30-43)47-32-46(37-11-5-3-6-12-37)49-48(50-47)38-13-7-4-8-14-38;1-32-19-23-34(24-20-32)38-15-9-17-40(27-38)42-29-43(41-18-10-16-39(28-41)35-25-21-33(2)22-26-35)31-44(30-42)47-49-45(36-11-5-3-6-12-36)48-46(50-47)37-13-7-4-8-14-37;1-32-14-6-8-22-42(32)37-20-12-18-35(26-37)39-28-40(36-19-13-21-38(27-36)43-23-9-7-15-33(43)2)30-41(29-39)45-31-46(44-24-10-11-25-48-44)50-47(49-45)34-16-4-3-5-17-34;1-4-5-6-7-8-9-16-44-45-30-43(31-46-44)42-28-40(38-14-10-12-36(25-38)34-21-17-32(2)18-22-34)27-41(29-42)39-15-11-13-37(26-39)35-23-19-33(3)20-24-35;1-29-11-6-15-32(23-29)34-17-8-18-35(25-34)37-20-10-22-39(27-37)41-28-40(43-42(44-41)31-13-4-3-5-14-31)38-21-9-19-36(26-38)33-16-7-12-30(2)24-33;1-29-10-6-14-32(20-29)34-16-8-18-36(22-34)38-24-39(37-19-9-17-35(23-37)33-15-7-11-30(2)21-33)26-40(25-38)42-43-27-41(28-44-42)31-12-4-3-5-13-31/h3*3-32H,1-2H3;2*3-31H,1-2H3;10-15,17-31H,4-9,16H2,1-3H3;2*3-28H,1-2H3
InChIKeyLZLCCTHRPYKQMV-UHFFFAOYSA-N
MW4936.44 g/mol
LogP97.12
Rot. Bonds59

About 2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-4,6-diphenylpyrimidine;4-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;4-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;5-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2-octylpyrimidine;4-[3,5-bis[3-(2-methylphenyl)phenyl]phenyl]-2-phenyl-6-pyridin-2-ylpyrimidine;2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-5-phenylpyrimidine;4-[3-(3-methylphenyl)phenyl]-6-[3-[3-(3-methylphenyl)phenyl]phenyl]-2-phenylpyrimidine

2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-4,6-diphenylpyrimidine;4-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;4-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;5-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2-octylpyrimidine;4-[3,5-bis[3-(2-methylphenyl)phenyl]phenyl]-2-phenyl-6-pyridin-2-ylpyrimidine;2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-5-phenylpyrimidine;4-[3-(3-methylphenyl)phenyl]-6-[3-[3-(3-methylphenyl)phenyl]phenyl]-2-phenylpyrimidine (PubChem CID 159501503) has the molecular formula C366H286N18 and a molecular weight of 4936.44 g/mol. Its IUPAC name is 2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-4,6-diphenylpyrimidine;4-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;4-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;5-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2-octylpyrimidine;4-[3,5-bis[3-(2-methylphenyl)phenyl]phenyl]-2-phenyl-6-pyridin-2-ylpyrimidine;2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-5-phenylpyrimidine;4-[3-(3-methylphenyl)phenyl]-6-[3-[3-(3-methylphenyl)phenyl]phenyl]-2-phenylpyrimidine.

Molecular Properties

Compound Name2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-4,6-diphenylpyrimidine;4-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;4-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;5-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2-octylpyrimidine;4-[3,5-bis[3-(2-methylphenyl)phenyl]phenyl]-2-phenyl-6-pyridin-2-ylpyrimidine;2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-5-phenylpyrimidine;4-[3-(3-methylphenyl)phenyl]-6-[3-[3-(3-methylphenyl)phenyl]phenyl]-2-phenylpyrimidine
PubChem CID159501503
Molecular FormulaC366H286N18
Molecular Weight4936.44 g/mol
Exact Mass4932.29
IUPAC Name2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-4,6-diphenylpyrimidine;4-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;4-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;5-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2-octylpyrimidine;4-[3,5-bis[3-(2-methylphenyl)phenyl]phenyl]-2-phenyl-6-pyridin-2-ylpyrimidine;2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-5-phenylpyrimidine;4-[3-(3-methylphenyl)phenyl]-6-[3-[3-(3-methylphenyl)phenyl]phenyl]-2-phenylpyrimidine
SMILESCCCCCCCCc1ncc(-c2cc(-c3cccc(-c4ccc(C)cc4)c3)cc(-c3cccc(-c4ccc(C)cc4)c3)c2)cn1.Cc1ccc(-c2cccc(-c3cc(-c4cccc(-c5ccc(C)cc5)c4)cc(-c4cc(-c5ccccc5)nc(-c5ccccc5)n4)c3)c2)cc1.Cc1ccc(-c2cccc(-c3cc(-c4cccc(-c5ccc(C)cc5)c4)cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)c2)cc1.Cc1cccc(-c2cccc(-c3cc(-c4cccc(-c5cccc(C)c5)c4)cc(-c4cc(-c5ccccc5)nc(-c5ccccc5)n4)c3)c2)c1.Cc1cccc(-c2cccc(-c3cc(-c4cccc(-c5cccc(C)c5)c4)cc(-c4nc(-c5ccccc5)cc(-c5ccccc5)n4)c3)c2)c1.Cc1cccc(-c2cccc(-c3cc(-c4cccc(-c5cccc(C)c5)c4)cc(-c4ncc(-c5ccccc5)cn4)c3)c2)c1.Cc1cccc(-c2cccc(-c3cccc(-c4cc(-c5cccc(-c6cccc(C)c6)c5)nc(-c5ccccc5)n4)c3)c2)c1.Cc1ccccc1-c1cccc(-c2cc(-c3cccc(-c4ccccc4C)c3)cc(-c3cc(-c4ccccn4)nc(-c4ccccc4)n3)c2)c1
InChIInChI=1S/3C48H36N2.2C47H35N3.C44H44N2.2C42H32N2/c1-33-13-9-19-37(25-33)39-21-11-23-41(27-39)43-29-44(42-24-12-22-40(28-42)38-20-10-14-34(2)26-38)31-45(30-43)47-32-46(35-15-5-3-6-16-35)49-48(50-47)36-17-7-4-8-18-36;1-33-13-9-19-37(25-33)39-21-11-23-41(27-39)43-29-44(42-24-12-22-40(28-42)38-20-10-14-34(2)26-38)31-45(30-43)48-49-46(35-15-5-3-6-16-35)32-47(50-48)36-17-7-4-8-18-36;1-33-19-23-35(24-20-33)39-15-9-17-41(27-39)43-29-44(42-18-10-16-40(28-42)36-25-21-34(2)22-26-36)31-45(30-43)47-32-46(37-11-5-3-6-12-37)49-48(50-47)38-13-7-4-8-14-38;1-32-19-23-34(24-20-32)38-15-9-17-40(27-38)42-29-43(41-18-10-16-39(28-41)35-25-21-33(2)22-26-35)31-44(30-42)47-49-45(36-11-5-3-6-12-36)48-46(50-47)37-13-7-4-8-14-37;1-32-14-6-8-22-42(32)37-20-12-18-35(26-37)39-28-40(36-19-13-21-38(27-36)43-23-9-7-15-33(43)2)30-41(29-39)45-31-46(44-24-10-11-25-48-44)50-47(49-45)34-16-4-3-5-17-34;1-4-5-6-7-8-9-16-44-45-30-43(31-46-44)42-28-40(38-14-10-12-36(25-38)34-21-17-32(2)18-22-34)27-41(29-42)39-15-11-13-37(26-39)35-23-19-33(3)20-24-35;1-29-11-6-15-32(23-29)34-17-8-18-35(25-34)37-20-10-22-39(27-37)41-28-40(43-42(44-41)31-13-4-3-5-14-31)38-21-9-19-36(26-38)33-16-7-12-30(2)24-33;1-29-10-6-14-32(20-29)34-16-8-18-36(22-34)38-24-39(37-19-9-17-35(23-37)33-15-7-11-30(2)21-33)26-40(25-38)42-43-27-41(28-44-42)31-12-4-3-5-13-31/h3*3-32H,1-2H3;2*3-31H,1-2H3;10-15,17-31H,4-9,16H2,1-3H3;2*3-28H,1-2H3
InChIKeyLZLCCTHRPYKQMV-UHFFFAOYSA-N
XLogP97.12
TPSA232.02 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds59
Heavy Atoms384
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004936.44
LogP ≤ 597.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-4,6-diphenylpyrimidine;4-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;4-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;5-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2-octylpyrimidine;4-[3,5-bis[3-(2-methylphenyl)phenyl]phenyl]-2-phenyl-6-pyridin-2-ylpyrimidine;2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-5-phenylpyrimidine;4-[3-(3-methylphenyl)phenyl]-6-[3-[3-(3-methylphenyl)phenyl]phenyl]-2-phenylpyrimidine with MolForge

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Related Compounds

5-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2-octylpyrimidine
CID 59194506
2-[3-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 126730905
4-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 159273767
5-[3,5-bis(3-methylphenyl)phenyl]-2-[5-[3,5-bis(3-methylphenyl)phenyl]-2-pyridinyl]pyridine;5-[3,5-bis(3-methylphenyl)phenyl]-2-pyridin-2-ylpyridine;2-[4-(2,5-dimethylphenyl)phenyl]-6-pyridin-2-ylpyridine;2-[5-(2,5-dimethylphenyl)-2-pyridinyl]-5-(3,5-diphenylphenyl)pyridine;2-[3-(4-methylphenyl)phenyl]-6-[6-[3-(4-methylphenyl)phenyl]-2-pyridinyl]pyridine;2-[4-(3-methylphenyl)phenyl]-6-[6-[4-(3-methylphenyl)phenyl]-2-pyridinyl]pyridine
CID 157138374
4-[3-[3-(3-butan-2-ylphenyl)phenyl]phenyl]-2-[3-(3,5-dimethylphenyl)phenyl]-6-phenylpyrimidine;4-[3-(3,5-dimethylphenyl)phenyl]-6-[3-[3-(3-methylphenyl)phenyl]phenyl]-2-phenylpyrimidine;2-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-4-[3-(2-methylphenyl)phenyl]-6-phenylpyrimidine;2-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-4-[3-(4-methylphenyl)phenyl]-6-phenylpyrimidine;4-[2-[3-(3,5-dimethylphenyl)phenyl]phenyl]-5-[3-(2-methylphenyl)phenyl]-2-phenylpyrimidine;4-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-2-[3-(4-methylphenyl)phenyl]-6-phenylpyrimidine
CID 160924050
2,4-diphenyl-6-[4-[4-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]phenyl]phenyl]pyrimidine;2,4-diphenyl-6-[4-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]phenyl]pyrimidine;2-phenyl-4-(3-phenylphenyl)-6-[4-[4-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]phenyl]phenyl]pyrimidine;2-phenyl-4-(3-phenylphenyl)-6-[4-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]phenyl]pyrimidine
CID 167549240
2-(4-methylphenyl)-4,6-diphenylpyrimidine;4-(4-methylphenyl)-2,6-diphenylpyrimidine;2-[3-(3-methylphenyl)phenyl]-4,6-diphenylpyridine;4-[3-(3-methylphenyl)phenyl]-2,6-diphenylpyridine;2-[3-(3-methylphenyl)phenyl]-4,6-diphenylpyrimidine;4-[3-(3-methylphenyl)phenyl]-2,6-diphenylpyrimidine
CID 159145948
2,4-diphenyl-6-[3-[2-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]phenyl]phenyl]pyrimidine
CID 163565213
2-[3-(7-methyl-9,9-dioctylfluoren-2-yl)-5-[7-(5-methylnaphthalen-1-yl)-9,9-dioctylfluoren-2-yl]phenyl]-4,6-diphenylpyrimidine
CID 118345499
2-(4-hexylphenyl)-4,6-diphenylpyrimidine;2-(4-methylphenyl)-4,6-diphenylpyrimidine;2-(4-methylphenyl)-4,6-di(pyrimidin-2-yl)-1,3,5-triazine;2-(4-methylphenyl)-4,6-di(pyrimidin-5-yl)-1,3,5-triazine;2-(5-methyl-2-pyridinyl)-4,6-dipyridin-2-yl-1,3,5-triazine
CID 160638422
4,6-diphenyl-2-[3-(4-pyridin-2-ylphenyl)-5-(4-pyrimidin-2-ylphenyl)phenyl]pyrimidine
CID 129292650
2-(4-methylphenyl)-4,6-diphenylpyrimidine;2-(3-methylphenyl)-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4-phenyl-6-(4-phenylphenyl)pyrimidine;2-(4-methylphenyl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 162112872

Frequently Asked Questions

What is the IUPAC name of 2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-4,6-diphenylpyrimidine;4-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;4-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;5-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2-octylpyrimidine;4-[3,5-bis[3-(2-methylphenyl)phenyl]phenyl]-2-phenyl-6-pyridin-2-ylpyrimidine;2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-5-phenylpyrimidine;4-[3-(3-methylphenyl)phenyl]-6-[3-[3-(3-methylphenyl)phenyl]phenyl]-2-phenylpyrimidine?
The IUPAC name of 2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-4,6-diphenylpyrimidine;4-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;4-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;5-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2-octylpyrimidine;4-[3,5-bis[3-(2-methylphenyl)phenyl]phenyl]-2-phenyl-6-pyridin-2-ylpyrimidine;2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-5-phenylpyrimidine;4-[3-(3-methylphenyl)phenyl]-6-[3-[3-(3-methylphenyl)phenyl]phenyl]-2-phenylpyrimidine (CID 159501503) is 2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-4,6-diphenylpyrimidine;4-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;4-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;5-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2-octylpyrimidine;4-[3,5-bis[3-(2-methylphenyl)phenyl]phenyl]-2-phenyl-6-pyridin-2-ylpyrimidine;2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-5-phenylpyrimidine;4-[3-(3-methylphenyl)phenyl]-6-[3-[3-(3-methylphenyl)phenyl]phenyl]-2-phenylpyrimidine.
What is the SMILES notation for 2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-4,6-diphenylpyrimidine;4-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;4-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;5-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2-octylpyrimidine;4-[3,5-bis[3-(2-methylphenyl)phenyl]phenyl]-2-phenyl-6-pyridin-2-ylpyrimidine;2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-5-phenylpyrimidine;4-[3-(3-methylphenyl)phenyl]-6-[3-[3-(3-methylphenyl)phenyl]phenyl]-2-phenylpyrimidine?
The canonical SMILES for 2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-4,6-diphenylpyrimidine;4-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;4-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;5-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2-octylpyrimidine;4-[3,5-bis[3-(2-methylphenyl)phenyl]phenyl]-2-phenyl-6-pyridin-2-ylpyrimidine;2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-5-phenylpyrimidine;4-[3-(3-methylphenyl)phenyl]-6-[3-[3-(3-methylphenyl)phenyl]phenyl]-2-phenylpyrimidine is CCCCCCCCc1ncc(-c2cc(-c3cccc(-c4ccc(C)cc4)c3)cc(-c3cccc(-c4ccc(C)cc4)c3)c2)cn1.Cc1ccc(-c2cccc(-c3cc(-c4cccc(-c5ccc(C)cc5)c4)cc(-c4cc(-c5ccccc5)nc(-c5ccccc5)n4)c3)c2)cc1.Cc1ccc(-c2cccc(-c3cc(-c4cccc(-c5ccc(C)cc5)c4)cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)c2)cc1.Cc1cccc(-c2cccc(-c3cc(-c4cccc(-c5cccc(C)c5)c4)cc(-c4cc(-c5ccccc5)nc(-c5ccccc5)n4)c3)c2)c1.Cc1cccc(-c2cccc(-c3cc(-c4cccc(-c5cccc(C)c5)c4)cc(-c4nc(-c5ccccc5)cc(-c5ccccc5)n4)c3)c2)c1.Cc1cccc(-c2cccc(-c3cc(-c4cccc(-c5cccc(C)c5)c4)cc(-c4ncc(-c5ccccc5)cn4)c3)c2)c1.Cc1cccc(-c2cccc(-c3cccc(-c4cc(-c5cccc(-c6cccc(C)c6)c5)nc(-c5ccccc5)n4)c3)c2)c1.Cc1ccccc1-c1cccc(-c2cc(-c3cccc(-c4ccccc4C)c3)cc(-c3cc(-c4ccccn4)nc(-c4ccccc4)n3)c2)c1.
What is the InChIKey of 2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-4,6-diphenylpyrimidine;4-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;4-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;5-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2-octylpyrimidine;4-[3,5-bis[3-(2-methylphenyl)phenyl]phenyl]-2-phenyl-6-pyridin-2-ylpyrimidine;2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-5-phenylpyrimidine;4-[3-(3-methylphenyl)phenyl]-6-[3-[3-(3-methylphenyl)phenyl]phenyl]-2-phenylpyrimidine?
The InChIKey is LZLCCTHRPYKQMV-UHFFFAOYSA-N. The full InChI is InChI=1S/3C48H36N2.2C47H35N3.C44H44N2.2C42H32N2/c1-33-13-9-19-37(25-33)39-21-11-23-41(27-39)43-29-44(42-24-12-22-40(28-42)38-20-10-14-34(2)26-38)31-45(30-43)47-32-46(35-15-5-3-6-16-35)49-48(50-47)36-17-7-4-8-18-36;1-33-13-9-19-37(25-33)39-21-11-23-41(27-39)43-29-44(42-24-12-22-40(28-42)38-20-10-14-34(2)26-38)31-45(30-43)48-49-46(35-15-5-3-6-16-35)32-47(50-48)36-17-7-4-8-18-36;1-33-19-23-35(24-20-33)39-15-9-17-41(27-39)43-29-44(42-18-10-16-40(28-42)36-25-21-34(2)22-26-36)31-45(30-43)47-32-46(37-11-5-3-6-12-37)49-48(50-47)38-13-7-4-8-14-38;1-32-19-23-34(24-20-32)38-15-9-17-40(27-38)42-29-43(41-18-10-16-39(28-41)35-25-21-33(2)22-26-35)31-44(30-42)47-49-45(36-11-5-3-6-12-36)48-46(50-47)37-13-7-4-8-14-37;1-32-14-6-8-22-42(32)37-20-12-18-35(26-37)39-28-40(36-19-13-21-38(27-36)43-23-9-7-15-33(43)2)30-41(29-39)45-31-46(44-24-10-11-25-48-44)50-47(49-45)34-16-4-3-5-17-34;1-4-5-6-7-8-9-16-44-45-30-43(31-46-44)42-28-40(38-14-10-12-36(25-38)34-21-17-32(2)18-22-34)27-41(29-42)39-15-11-13-37(26-39)35-23-19-33(3)20-24-35;1-29-11-6-15-32(23-29)34-17-8-18-35(25-34)37-20-10-22-39(27-37)41-28-40(43-42(44-41)31-13-4-3-5-14-31)38-21-9-19-36(26-38)33-16-7-12-30(2)24-33;1-29-10-6-14-32(20-29)34-16-8-18-36(22-34)38-24-39(37-19-9-17-35(23-37)33-15-7-11-30(2)21-33)26-40(25-38)42-43-27-41(28-44-42)31-12-4-3-5-13-31/h3*3-32H,1-2H3;2*3-31H,1-2H3;10-15,17-31H,4-9,16H2,1-3H3;2*3-28H,1-2H3.
What are the key properties of 2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-4,6-diphenylpyrimidine;4-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;4-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;5-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2-octylpyrimidine;4-[3,5-bis[3-(2-methylphenyl)phenyl]phenyl]-2-phenyl-6-pyridin-2-ylpyrimidine;2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-5-phenylpyrimidine;4-[3-(3-methylphenyl)phenyl]-6-[3-[3-(3-methylphenyl)phenyl]phenyl]-2-phenylpyrimidine?
2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-4,6-diphenylpyrimidine;4-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;4-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;5-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2-octylpyrimidine;4-[3,5-bis[3-(2-methylphenyl)phenyl]phenyl]-2-phenyl-6-pyridin-2-ylpyrimidine;2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-5-phenylpyrimidine;4-[3-(3-methylphenyl)phenyl]-6-[3-[3-(3-methylphenyl)phenyl]phenyl]-2-phenylpyrimidine has a molecular weight of 4936.44 g/mol, XLogP of 97.12, 59 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-4,6-diphenylpyrimidine;4-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;4-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;5-[3,5-bis[3-(4-methylphenyl)phenyl]phenyl]-2-octylpyrimidine;4-[3,5-bis[3-(2-methylphenyl)phenyl]phenyl]-2-phenyl-6-pyridin-2-ylpyrimidine;2-[3,5-bis[3-(3-methylphenyl)phenyl]phenyl]-5-phenylpyrimidine;4-[3-(3-methylphenyl)phenyl]-6-[3-[3-(3-methylphenyl)phenyl]phenyl]-2-phenylpyrimidine is sourced from PubChem (CID 159501503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).