2-[5-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;3-(2,4,4,5,5-pentamethylimidazol-1-yl)-5-[3-[5-(2,4,4,5,5-pentamethylimidazol-1-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]pyridine;2-[3-(4-phenylphenyl)-5-[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]phenyl]-5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)pyridine

C248H234N30O8 — CID 158972695

IUPAC2-[5-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;3-(2,4,4,5,5-pentamethylimidazol-1-yl)-5-[3-[5-(2,4,4,5,5-pentamethylimidazol-1-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]pyridine;2-[3-(4-phenylphenyl)-5-[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]phenyl]-5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)pyridine
SMILESCC1(C)COC(c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-c4ccc(C5=NC(C)(C)CO5)cn4)c3)nc2)=N1.CC1(C)COC(c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-c4ccc(C5=NC(C)(C)CO5)cn4)n3)nc2)=N1.CC1(C)COC(c2cncc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-c4cncc(C5=NC(C)(C)CO5)c4)c3)c2)=N1.CC1(C)COC(c2cncc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-c4cncc(C5=NC(C)(C)CO5)c4)n3)c2)=N1.CC1(C)N=C(c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-c4ccc(C5=NC(C)(C)C(C)(C)N5c5ccccc5)cn4)c3)nc2)N(c2ccccc2)C1(C)C.CC1=NC(C)(C)C(C)(C)N1c1cncc(-c2cc(-c3ccc(-c4ccccc4)cc3)cc(-c3cncc(N4C(C)=NC(C)(C)C4(C)C)c3)c2)c1
InChIInChI=1S/C54H52N6.C44H48N6.2C38H34N4O2.2C37H33N5O2/c1-51(2)53(5,6)59(45-20-14-10-15-21-45)49(57-51)40-28-30-47(55-35-40)43-32-42(39-26-24-38(25-27-39)37-18-12-9-13-19-37)33-44(34-43)48-31-29-41(36-56-48)50-58-52(3,4)54(7,8)60(50)46-22-16-11-17-23-46;1-29-47-41(3,4)43(7,8)49(29)39-23-37(25-45-27-39)35-20-34(33-18-16-32(17-19-33)31-14-12-11-13-15-31)21-36(22-35)38-24-40(28-46-26-38)50-30(2)48-42(5,6)44(50,9)10;1-37(2)23-43-35(41-37)33-17-31(19-39-21-33)29-14-28(27-12-10-26(11-13-27)25-8-6-5-7-9-25)15-30(16-29)32-18-34(22-40-20-32)36-42-38(3,4)24-44-36;1-37(2)23-43-35(41-37)28-14-16-33(39-21-28)31-18-30(27-12-10-26(11-13-27)25-8-6-5-7-9-25)19-32(20-31)34-17-15-29(22-40-34)36-42-38(3,4)24-44-36;1-36(2)22-43-34(41-36)30-14-28(18-38-20-30)32-16-27(26-12-10-25(11-13-26)24-8-6-5-7-9-24)17-33(40-32)29-15-31(21-39-19-29)35-42-37(3,4)23-44-35;1-36(2)22-43-34(41-36)27-14-16-30(38-20-27)32-18-29(26-12-10-25(11-13-26)24-8-6-5-7-9-24)19-33(40-32)31-17-15-28(21-39-31)35-42-37(3,4)23-44-35/h9-36H,1-8H3;11-28H,1-10H3;2*5-22H,23-24H2,1-4H3;2*5-21H,22-23H2,1-4H3
InChIKeyJNZZRMNFBKPKEW-UHFFFAOYSA-N
MW3762.80 g/mol
LogP55.34
Rot. Bonds38

About 2-[5-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;3-(2,4,4,5,5-pentamethylimidazol-1-yl)-5-[3-[5-(2,4,4,5,5-pentamethylimidazol-1-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]pyridine;2-[3-(4-phenylphenyl)-5-[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]phenyl]-5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)pyridine

2-[5-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;3-(2,4,4,5,5-pentamethylimidazol-1-yl)-5-[3-[5-(2,4,4,5,5-pentamethylimidazol-1-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]pyridine;2-[3-(4-phenylphenyl)-5-[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]phenyl]-5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)pyridine (PubChem CID 158972695) has the molecular formula C248H234N30O8 and a molecular weight of 3762.80 g/mol. Its IUPAC name is 2-[5-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;3-(2,4,4,5,5-pentamethylimidazol-1-yl)-5-[3-[5-(2,4,4,5,5-pentamethylimidazol-1-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]pyridine;2-[3-(4-phenylphenyl)-5-[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]phenyl]-5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)pyridine.

Molecular Properties

Compound Name2-[5-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;3-(2,4,4,5,5-pentamethylimidazol-1-yl)-5-[3-[5-(2,4,4,5,5-pentamethylimidazol-1-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]pyridine;2-[3-(4-phenylphenyl)-5-[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]phenyl]-5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)pyridine
PubChem CID158972695
Molecular FormulaC248H234N30O8
Molecular Weight3762.80 g/mol
Exact Mass3759.88
IUPAC Name2-[5-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;3-(2,4,4,5,5-pentamethylimidazol-1-yl)-5-[3-[5-(2,4,4,5,5-pentamethylimidazol-1-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]pyridine;2-[3-(4-phenylphenyl)-5-[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]phenyl]-5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)pyridine
SMILESCC1(C)COC(c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-c4ccc(C5=NC(C)(C)CO5)cn4)c3)nc2)=N1.CC1(C)COC(c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-c4ccc(C5=NC(C)(C)CO5)cn4)n3)nc2)=N1.CC1(C)COC(c2cncc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-c4cncc(C5=NC(C)(C)CO5)c4)c3)c2)=N1.CC1(C)COC(c2cncc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-c4cncc(C5=NC(C)(C)CO5)c4)n3)c2)=N1.CC1(C)N=C(c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-c4ccc(C5=NC(C)(C)C(C)(C)N5c5ccccc5)cn4)c3)nc2)N(c2ccccc2)C1(C)C.CC1=NC(C)(C)C(C)(C)N1c1cncc(-c2cc(-c3ccc(-c4ccccc4)cc3)cc(-c3cncc(N4C(C)=NC(C)(C)C4(C)C)c3)c2)c1
InChIInChI=1S/C54H52N6.C44H48N6.2C38H34N4O2.2C37H33N5O2/c1-51(2)53(5,6)59(45-20-14-10-15-21-45)49(57-51)40-28-30-47(55-35-40)43-32-42(39-26-24-38(25-27-39)37-18-12-9-13-19-37)33-44(34-43)48-31-29-41(36-56-48)50-58-52(3,4)54(7,8)60(50)46-22-16-11-17-23-46;1-29-47-41(3,4)43(7,8)49(29)39-23-37(25-45-27-39)35-20-34(33-18-16-32(17-19-33)31-14-12-11-13-15-31)21-36(22-35)38-24-40(28-46-26-38)50-30(2)48-42(5,6)44(50,9)10;1-37(2)23-43-35(41-37)33-17-31(19-39-21-33)29-14-28(27-12-10-26(11-13-27)25-8-6-5-7-9-25)15-30(16-29)32-18-34(22-40-20-32)36-42-38(3,4)24-44-36;1-37(2)23-43-35(41-37)28-14-16-33(39-21-28)31-18-30(27-12-10-26(11-13-27)25-8-6-5-7-9-25)19-32(20-31)34-17-15-29(22-40-34)36-42-38(3,4)24-44-36;1-36(2)22-43-34(41-36)30-14-28(18-38-20-30)32-16-27(26-12-10-25(11-13-26)24-8-6-5-7-9-24)17-33(40-32)29-15-31(21-39-19-29)35-42-37(3,4)23-44-35;1-36(2)22-43-34(41-36)27-14-16-30(38-20-27)32-18-29(26-12-10-25(11-13-26)24-8-6-5-7-9-24)19-33(40-32)31-17-15-28(21-39-31)35-42-37(3,4)23-44-35/h9-36H,1-8H3;11-28H,1-10H3;2*5-22H,23-24H2,1-4H3;2*5-21H,22-23H2,1-4H3
InChIKeyJNZZRMNFBKPKEW-UHFFFAOYSA-N
XLogP55.34
TPSA415.58 Ų
H-Bond Donors
H-Bond Acceptors38
Rotatable Bonds38
Heavy Atoms286
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003762.80
LogP ≤ 555.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1038

Analyze 2-[5-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;3-(2,4,4,5,5-pentamethylimidazol-1-yl)-5-[3-[5-(2,4,4,5,5-pentamethylimidazol-1-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]pyridine;2-[3-(4-phenylphenyl)-5-[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]phenyl]-5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[5-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;3-(2,4,4,5,5-pentamethylimidazol-1-yl)-5-[3-[5-(2,4,4,5,5-pentamethylimidazol-1-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]pyridine;2-[3-(4-phenylphenyl)-5-[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]phenyl]-5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)pyridine?
The IUPAC name of 2-[5-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;3-(2,4,4,5,5-pentamethylimidazol-1-yl)-5-[3-[5-(2,4,4,5,5-pentamethylimidazol-1-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]pyridine;2-[3-(4-phenylphenyl)-5-[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]phenyl]-5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)pyridine (CID 158972695) is 2-[5-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;3-(2,4,4,5,5-pentamethylimidazol-1-yl)-5-[3-[5-(2,4,4,5,5-pentamethylimidazol-1-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]pyridine;2-[3-(4-phenylphenyl)-5-[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]phenyl]-5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)pyridine.
What is the SMILES notation for 2-[5-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;3-(2,4,4,5,5-pentamethylimidazol-1-yl)-5-[3-[5-(2,4,4,5,5-pentamethylimidazol-1-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]pyridine;2-[3-(4-phenylphenyl)-5-[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]phenyl]-5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)pyridine?
The canonical SMILES for 2-[5-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;3-(2,4,4,5,5-pentamethylimidazol-1-yl)-5-[3-[5-(2,4,4,5,5-pentamethylimidazol-1-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]pyridine;2-[3-(4-phenylphenyl)-5-[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]phenyl]-5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)pyridine is CC1(C)COC(c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-c4ccc(C5=NC(C)(C)CO5)cn4)c3)nc2)=N1.CC1(C)COC(c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-c4ccc(C5=NC(C)(C)CO5)cn4)n3)nc2)=N1.CC1(C)COC(c2cncc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-c4cncc(C5=NC(C)(C)CO5)c4)c3)c2)=N1.CC1(C)COC(c2cncc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-c4cncc(C5=NC(C)(C)CO5)c4)n3)c2)=N1.CC1(C)N=C(c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-c4ccc(C5=NC(C)(C)C(C)(C)N5c5ccccc5)cn4)c3)nc2)N(c2ccccc2)C1(C)C.CC1=NC(C)(C)C(C)(C)N1c1cncc(-c2cc(-c3ccc(-c4ccccc4)cc3)cc(-c3cncc(N4C(C)=NC(C)(C)C4(C)C)c3)c2)c1.
What is the InChIKey of 2-[5-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;3-(2,4,4,5,5-pentamethylimidazol-1-yl)-5-[3-[5-(2,4,4,5,5-pentamethylimidazol-1-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]pyridine;2-[3-(4-phenylphenyl)-5-[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]phenyl]-5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)pyridine?
The InChIKey is JNZZRMNFBKPKEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H52N6.C44H48N6.2C38H34N4O2.2C37H33N5O2/c1-51(2)53(5,6)59(45-20-14-10-15-21-45)49(57-51)40-28-30-47(55-35-40)43-32-42(39-26-24-38(25-27-39)37-18-12-9-13-19-37)33-44(34-43)48-31-29-41(36-56-48)50-58-52(3,4)54(7,8)60(50)46-22-16-11-17-23-46;1-29-47-41(3,4)43(7,8)49(29)39-23-37(25-45-27-39)35-20-34(33-18-16-32(17-19-33)31-14-12-11-13-15-31)21-36(22-35)38-24-40(28-46-26-38)50-30(2)48-42(5,6)44(50,9)10;1-37(2)23-43-35(41-37)33-17-31(19-39-21-33)29-14-28(27-12-10-26(11-13-27)25-8-6-5-7-9-25)15-30(16-29)32-18-34(22-40-20-32)36-42-38(3,4)24-44-36;1-37(2)23-43-35(41-37)28-14-16-33(39-21-28)31-18-30(27-12-10-26(11-13-27)25-8-6-5-7-9-25)19-32(20-31)34-17-15-29(22-40-34)36-42-38(3,4)24-44-36;1-36(2)22-43-34(41-36)30-14-28(18-38-20-30)32-16-27(26-12-10-25(11-13-26)24-8-6-5-7-9-24)17-33(40-32)29-15-31(21-39-19-29)35-42-37(3,4)23-44-35;1-36(2)22-43-34(41-36)27-14-16-30(38-20-27)32-18-29(26-12-10-25(11-13-26)24-8-6-5-7-9-24)19-33(40-32)31-17-15-28(21-39-31)35-42-37(3,4)23-44-35/h9-36H,1-8H3;11-28H,1-10H3;2*5-22H,23-24H2,1-4H3;2*5-21H,22-23H2,1-4H3.
What are the key properties of 2-[5-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;3-(2,4,4,5,5-pentamethylimidazol-1-yl)-5-[3-[5-(2,4,4,5,5-pentamethylimidazol-1-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]pyridine;2-[3-(4-phenylphenyl)-5-[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]phenyl]-5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)pyridine?
2-[5-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;3-(2,4,4,5,5-pentamethylimidazol-1-yl)-5-[3-[5-(2,4,4,5,5-pentamethylimidazol-1-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]pyridine;2-[3-(4-phenylphenyl)-5-[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]phenyl]-5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)pyridine has a molecular weight of 3762.80 g/mol, XLogP of 55.34, 38 rotatable bonds, 0 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[3-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-5-(4-phenylphenyl)phenyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[6-[6-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-pyridinyl]-4-(4-phenylphenyl)-2-pyridinyl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;3-(2,4,4,5,5-pentamethylimidazol-1-yl)-5-[3-[5-(2,4,4,5,5-pentamethylimidazol-1-yl)-3-pyridinyl]-5-(4-phenylphenyl)phenyl]pyridine;2-[3-(4-phenylphenyl)-5-[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]phenyl]-5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)pyridine is sourced from PubChem (CID 158972695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).