2-(4-dibenzofuran-4-yldibenzofuran-1-yl)-4-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-2-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-6-(3,5-diphenylphenyl)-2-phenylpyrimidine;2-(1-dibenzofuran-2-yldibenzofuran-4-yl)-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;2-[4-(1-dibenzofuran-3-yldibenzofuran-4-yl)phenyl]-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;4-[4-(4-dibenzothiophen-4-yldibenzofuran-1-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine

C316H194N14O11S — CID 157170313

IUPAC2-(4-dibenzofuran-4-yldibenzofuran-1-yl)-4-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-2-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-6-(3,5-diphenylphenyl)-2-phenylpyrimidine;2-(1-dibenzofuran-2-yldibenzofuran-4-yl)-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;2-[4-(1-dibenzofuran-3-yldibenzofuran-4-yl)phenyl]-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;4-[4-(4-dibenzothiophen-4-yldibenzofuran-1-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3cc(-c4ccc(-c5cccc6c5oc5ccccc56)c5oc6ccccc6c45)nc(-c4ccccc4)n3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3cc(-c4ccccc4)nc(-c4ccc(-c5cccc6c5oc5ccccc56)c5oc6ccccc6c45)n3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4ccccc4)cc(-c4ccc(-c5cccc6c5oc5ccccc56)c5oc6ccccc6c45)n3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4ccccc4)nc(-c4ccc(-c5ccc(-c6ccc7c(c6)oc6ccccc67)c6c5oc5ccccc56)cc4)n3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4ccccc4)nc(-c4ccc(-c5ccc6oc7ccccc7c6c5)c5c4oc4ccccc45)n3)c2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccc(-c6cccc7c6sc6ccccc67)c6oc7ccccc7c56)cc4)nc(-c4ccccc4)n3)cc2)cc1
InChIInChI=1S/C57H35N3O2.3C52H32N2O2.C52H32N2OS.C51H31N3O2/c1-4-14-36(15-5-1)42-32-43(37-16-6-2-7-17-37)34-44(33-42)57-59-55(39-18-8-3-9-19-39)58-56(60-57)40-26-24-38(25-27-40)46-31-30-45(53-49-21-11-13-23-51(49)62-54(46)53)41-28-29-48-47-20-10-12-22-50(47)61-52(48)35-41;1-4-15-33(16-5-1)36-29-37(34-17-6-2-7-18-34)31-38(30-36)45-32-46(54-52(53-45)35-19-8-3-9-20-35)43-28-27-42(51-49(43)44-22-11-13-26-48(44)56-51)41-24-14-23-40-39-21-10-12-25-47(39)55-50(40)41;1-4-15-33(16-5-1)36-29-37(34-17-6-2-7-18-34)31-38(30-36)52-53-45(35-19-8-3-9-20-35)32-46(54-52)43-28-27-42(51-49(43)44-22-11-13-26-48(44)56-51)41-24-14-23-40-39-21-10-12-25-47(39)55-50(40)41;1-4-15-33(16-5-1)36-29-37(34-17-6-2-7-18-34)31-38(30-36)46-32-45(35-19-8-3-9-20-35)53-52(54-46)44-28-27-42(51-49(44)43-22-11-13-26-48(43)56-51)41-24-14-23-40-39-21-10-12-25-47(39)55-50(40)41;1-3-12-33(13-4-1)34-22-26-36(27-23-34)45-32-46(54-52(53-45)38-14-5-2-6-15-38)37-28-24-35(25-29-37)39-30-31-41(50-49(39)44-17-7-9-20-47(44)55-50)43-19-11-18-42-40-16-8-10-21-48(40)56-51(42)43;1-4-14-32(15-5-1)36-28-37(33-16-6-2-7-17-33)30-38(29-36)50-52-49(34-18-8-3-9-19-34)53-51(54-50)42-26-25-39(47-41-21-11-13-23-45(41)56-48(42)47)35-24-27-46-43(31-35)40-20-10-12-22-44(40)55-46/h1-35H;4*1-32H;1-31H
InChIKeyANJRGVFVAUCAAF-UHFFFAOYSA-N
MW4395.18 g/mol
LogP86.59
Rot. Bonds37

About 2-(4-dibenzofuran-4-yldibenzofuran-1-yl)-4-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-2-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-6-(3,5-diphenylphenyl)-2-phenylpyrimidine;2-(1-dibenzofuran-2-yldibenzofuran-4-yl)-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;2-[4-(1-dibenzofuran-3-yldibenzofuran-4-yl)phenyl]-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;4-[4-(4-dibenzothiophen-4-yldibenzofuran-1-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine

2-(4-dibenzofuran-4-yldibenzofuran-1-yl)-4-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-2-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-6-(3,5-diphenylphenyl)-2-phenylpyrimidine;2-(1-dibenzofuran-2-yldibenzofuran-4-yl)-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;2-[4-(1-dibenzofuran-3-yldibenzofuran-4-yl)phenyl]-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;4-[4-(4-dibenzothiophen-4-yldibenzofuran-1-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine (PubChem CID 157170313) has the molecular formula C316H194N14O11S and a molecular weight of 4395.18 g/mol. Its IUPAC name is 2-(4-dibenzofuran-4-yldibenzofuran-1-yl)-4-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-2-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-6-(3,5-diphenylphenyl)-2-phenylpyrimidine;2-(1-dibenzofuran-2-yldibenzofuran-4-yl)-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;2-[4-(1-dibenzofuran-3-yldibenzofuran-4-yl)phenyl]-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;4-[4-(4-dibenzothiophen-4-yldibenzofuran-1-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine.

Molecular Properties

Compound Name2-(4-dibenzofuran-4-yldibenzofuran-1-yl)-4-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-2-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-6-(3,5-diphenylphenyl)-2-phenylpyrimidine;2-(1-dibenzofuran-2-yldibenzofuran-4-yl)-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;2-[4-(1-dibenzofuran-3-yldibenzofuran-4-yl)phenyl]-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;4-[4-(4-dibenzothiophen-4-yldibenzofuran-1-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine
PubChem CID157170313
Molecular FormulaC316H194N14O11S
Molecular Weight4395.18 g/mol
Exact Mass4391.48
IUPAC Name2-(4-dibenzofuran-4-yldibenzofuran-1-yl)-4-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-2-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-6-(3,5-diphenylphenyl)-2-phenylpyrimidine;2-(1-dibenzofuran-2-yldibenzofuran-4-yl)-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;2-[4-(1-dibenzofuran-3-yldibenzofuran-4-yl)phenyl]-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;4-[4-(4-dibenzothiophen-4-yldibenzofuran-1-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3cc(-c4ccc(-c5cccc6c5oc5ccccc56)c5oc6ccccc6c45)nc(-c4ccccc4)n3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3cc(-c4ccccc4)nc(-c4ccc(-c5cccc6c5oc5ccccc56)c5oc6ccccc6c45)n3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4ccccc4)cc(-c4ccc(-c5cccc6c5oc5ccccc56)c5oc6ccccc6c45)n3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4ccccc4)nc(-c4ccc(-c5ccc(-c6ccc7c(c6)oc6ccccc67)c6c5oc5ccccc56)cc4)n3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4ccccc4)nc(-c4ccc(-c5ccc6oc7ccccc7c6c5)c5c4oc4ccccc45)n3)c2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccc(-c6cccc7c6sc6ccccc67)c6oc7ccccc7c56)cc4)nc(-c4ccccc4)n3)cc2)cc1
InChIInChI=1S/C57H35N3O2.3C52H32N2O2.C52H32N2OS.C51H31N3O2/c1-4-14-36(15-5-1)42-32-43(37-16-6-2-7-17-37)34-44(33-42)57-59-55(39-18-8-3-9-19-39)58-56(60-57)40-26-24-38(25-27-40)46-31-30-45(53-49-21-11-13-23-51(49)62-54(46)53)41-28-29-48-47-20-10-12-22-50(47)61-52(48)35-41;1-4-15-33(16-5-1)36-29-37(34-17-6-2-7-18-34)31-38(30-36)45-32-46(54-52(53-45)35-19-8-3-9-20-35)43-28-27-42(51-49(43)44-22-11-13-26-48(44)56-51)41-24-14-23-40-39-21-10-12-25-47(39)55-50(40)41;1-4-15-33(16-5-1)36-29-37(34-17-6-2-7-18-34)31-38(30-36)52-53-45(35-19-8-3-9-20-35)32-46(54-52)43-28-27-42(51-49(43)44-22-11-13-26-48(44)56-51)41-24-14-23-40-39-21-10-12-25-47(39)55-50(40)41;1-4-15-33(16-5-1)36-29-37(34-17-6-2-7-18-34)31-38(30-36)46-32-45(35-19-8-3-9-20-35)53-52(54-46)44-28-27-42(51-49(44)43-22-11-13-26-48(43)56-51)41-24-14-23-40-39-21-10-12-25-47(39)55-50(40)41;1-3-12-33(13-4-1)34-22-26-36(27-23-34)45-32-46(54-52(53-45)38-14-5-2-6-15-38)37-28-24-35(25-29-37)39-30-31-41(50-49(39)44-17-7-9-20-47(44)55-50)43-19-11-18-42-40-16-8-10-21-48(40)56-51(42)43;1-4-14-32(15-5-1)36-28-37(33-16-6-2-7-17-33)30-38(29-36)50-52-49(34-18-8-3-9-19-34)53-51(54-50)42-26-25-39(47-41-21-11-13-23-45(41)56-48(42)47)35-24-27-46-43(31-35)40-20-10-12-22-44(40)55-46/h1-35H;4*1-32H;1-31H
InChIKeyANJRGVFVAUCAAF-UHFFFAOYSA-N
XLogP86.59
TPSA325.00 Ų
H-Bond Donors
H-Bond Acceptors26
Rotatable Bonds37
Heavy Atoms342
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004395.18
LogP ≤ 586.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1026

Analyze 2-(4-dibenzofuran-4-yldibenzofuran-1-yl)-4-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-2-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-6-(3,5-diphenylphenyl)-2-phenylpyrimidine;2-(1-dibenzofuran-2-yldibenzofuran-4-yl)-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;2-[4-(1-dibenzofuran-3-yldibenzofuran-4-yl)phenyl]-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;4-[4-(4-dibenzothiophen-4-yldibenzofuran-1-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine with MolForge

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Related Compounds

2-dibenzofuran-1-yl-4-(7-dibenzofuran-4-yldibenzofuran-4-yl)-6-phenyl-1,3,5-triazine;2-dibenzofuran-2-yl-4-(7-dibenzofuran-4-yldibenzofuran-4-yl)-6-phenyl-1,3,5-triazine;2-(7-dibenzofuran-4-yldibenzofuran-4-yl)-4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazine;2-(7-dibenzofuran-4-yldibenzofuran-4-yl)-4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazine
CID 159607952
4-dibenzofuran-2-yl-6-[3,5-di(dibenzothiophen-2-yl)phenyl]-2-phenylpyrimidine;4-dibenzofuran-4-yl-6-[3,5-di(dibenzothiophen-4-yl)phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-6-[3,5-di(dibenzothiophen-2-yl)phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-4-ylphenyl)-6-[3,5-di(dibenzothiophen-4-yl)phenyl]-2-phenylpyrimidine;2-(4-dibenzothiophen-2-ylphenyl)-4-[3,5-di(dibenzofuran-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2-(4-dibenzothiophen-4-ylphenyl)-4-[3,5-di(dibenzofuran-4-yl)phenyl]-6-phenyl-1,3,5-triazine
CID 158434773
2-(4-dibenzothiophen-4-ylphenyl)-4-phenyl-6-(8-phenyldibenzofuran-1-yl)pyrimidine;2-(4-dibenzothiophen-4-ylphenyl)-4-phenyl-6-[8-(4-phenylphenyl)dibenzofuran-1-yl]pyrimidine;2-[3-(4-dibenzothiophen-4-ylphenyl)-5-phenylphenyl]-4-phenyl-6-(8-phenyldibenzofuran-1-yl)-1,3,5-triazine;2-phenyl-4-(8-phenyldibenzofuran-1-yl)-6-[4-[6-(3-phenylphenyl)dibenzothiophen-4-yl]phenyl]-1,3,5-triazine
CID 159109291
2-(4-dibenzothiophen-4-yldibenzofuran-1-yl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-(4-dibenzothiophen-4-yldibenzofuran-1-yl)-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine;8-[4-[4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-phenylpyrimidin-2-yl]phenyl]quinoline
CID 159172438
4-dibenzothiophen-4-yl-2-[4-[7-[8-[4-[4-dibenzothiophen-4-yl-6-(2-phenylphenyl)pyrimidin-2-yl]phenyl]dibenzofuran-2-yl]dibenzofuran-4-yl]phenyl]-6-(2-phenylphenyl)pyrimidine
CID 167197032
2-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]-4-phenyl-6-[6-(4-phenylphenyl)dibenzothiophen-1-yl]-1,3,5-triazine;2-[3-(2-dibenzothiophen-4-ylphenyl)-5-(3-phenylphenyl)phenyl]-4-phenyl-6-(8-phenyldibenzothiophen-1-yl)-1,3,5-triazine;2-phenyl-4-(8-phenyldibenzofuran-1-yl)-6-[4-[4-[4-(7-phenyldibenzofuran-4-yl)phenyl]phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(8-phenyldibenzothiophen-1-yl)-6-[3-[4-(6-phenyldibenzothiophen-4-yl)phenyl]phenyl]-1,3,5-triazine
CID 162198017
2-[4-(4-dibenzothiophen-4-yldibenzofuran-1-yl)phenyl]-4,6-bis(3-phenylphenyl)-1,3,5-triazine
CID 155078930
4-(3-dibenzofuran-2-ylphenyl)-6-[3,5-di(dibenzothiophen-2-yl)phenyl]-2-phenylpyrimidine;4-(3-dibenzofuran-4-ylphenyl)-6-[3,5-di(dibenzothiophen-4-yl)phenyl]-2-phenylpyrimidine;4-dibenzothiophen-2-yl-6-[3,5-di(dibenzofuran-2-yl)phenyl]-2-phenylpyrimidine;4-dibenzothiophen-4-yl-6-[3,5-di(dibenzofuran-4-yl)phenyl]-2-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-6-[3,5-di(dibenzofuran-2-yl)phenyl]-2-phenylpyrimidine;4-(4-dibenzothiophen-4-ylphenyl)-6-[3,5-di(dibenzofuran-4-yl)phenyl]-2-phenylpyrimidine
CID 160847317
2-(6-dibenzofuran-4-yldibenzofuran-3-yl)-4-[3-[4-[4-(6-dibenzofuran-4-yldibenzofuran-3-yl)-6-dibenzothiophen-4-yl-1,3,5-triazin-2-yl]phenyl]dibenzofuran-1-yl]-6-phenyl-1,3,5-triazine
CID 170141313
4-(4-dibenzofuran-1-ylphenyl)-2,6-diphenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-2,6-diphenylpyrimidine;4,6-di(dibenzofuran-3-yl)-2-phenylpyrimidine;4,6-di(dibenzofuran-4-yl)-2-phenylpyrimidine;2,4,6-tri(dibenzofuran-1-yl)pyrimidine;2,4,6-tri(dibenzofuran-2-yl)pyrimidine;2,4,6-tri(dibenzofuran-3-yl)pyrimidine;2,4,6-tri(dibenzofuran-4-yl)pyrimidine
CID 159391384
4-(3-dibenzofuran-2-yl-5-phenylphenyl)-6-(2-dibenzothiophen-4-ylphenyl)-2-phenylpyrimidine
CID 171584527
2-(3-dibenzofuran-4-ylphenyl)-4-dibenzothiophen-4-yl-6-(4-phenylphenyl)-1,3,5-triazine
CID 171445309

Frequently Asked Questions

What is the IUPAC name of 2-(4-dibenzofuran-4-yldibenzofuran-1-yl)-4-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-2-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-6-(3,5-diphenylphenyl)-2-phenylpyrimidine;2-(1-dibenzofuran-2-yldibenzofuran-4-yl)-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;2-[4-(1-dibenzofuran-3-yldibenzofuran-4-yl)phenyl]-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;4-[4-(4-dibenzothiophen-4-yldibenzofuran-1-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine?
The IUPAC name of 2-(4-dibenzofuran-4-yldibenzofuran-1-yl)-4-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-2-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-6-(3,5-diphenylphenyl)-2-phenylpyrimidine;2-(1-dibenzofuran-2-yldibenzofuran-4-yl)-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;2-[4-(1-dibenzofuran-3-yldibenzofuran-4-yl)phenyl]-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;4-[4-(4-dibenzothiophen-4-yldibenzofuran-1-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine (CID 157170313) is 2-(4-dibenzofuran-4-yldibenzofuran-1-yl)-4-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-2-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-6-(3,5-diphenylphenyl)-2-phenylpyrimidine;2-(1-dibenzofuran-2-yldibenzofuran-4-yl)-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;2-[4-(1-dibenzofuran-3-yldibenzofuran-4-yl)phenyl]-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;4-[4-(4-dibenzothiophen-4-yldibenzofuran-1-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine.
What is the SMILES notation for 2-(4-dibenzofuran-4-yldibenzofuran-1-yl)-4-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-2-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-6-(3,5-diphenylphenyl)-2-phenylpyrimidine;2-(1-dibenzofuran-2-yldibenzofuran-4-yl)-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;2-[4-(1-dibenzofuran-3-yldibenzofuran-4-yl)phenyl]-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;4-[4-(4-dibenzothiophen-4-yldibenzofuran-1-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine?
The canonical SMILES for 2-(4-dibenzofuran-4-yldibenzofuran-1-yl)-4-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-2-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-6-(3,5-diphenylphenyl)-2-phenylpyrimidine;2-(1-dibenzofuran-2-yldibenzofuran-4-yl)-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;2-[4-(1-dibenzofuran-3-yldibenzofuran-4-yl)phenyl]-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;4-[4-(4-dibenzothiophen-4-yldibenzofuran-1-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine is c1ccc(-c2cc(-c3ccccc3)cc(-c3cc(-c4ccc(-c5cccc6c5oc5ccccc56)c5oc6ccccc6c45)nc(-c4ccccc4)n3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3cc(-c4ccccc4)nc(-c4ccc(-c5cccc6c5oc5ccccc56)c5oc6ccccc6c45)n3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4ccccc4)cc(-c4ccc(-c5cccc6c5oc5ccccc56)c5oc6ccccc6c45)n3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4ccccc4)nc(-c4ccc(-c5ccc(-c6ccc7c(c6)oc6ccccc67)c6c5oc5ccccc56)cc4)n3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4ccccc4)nc(-c4ccc(-c5ccc6oc7ccccc7c6c5)c5c4oc4ccccc45)n3)c2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccc(-c6cccc7c6sc6ccccc67)c6oc7ccccc7c56)cc4)nc(-c4ccccc4)n3)cc2)cc1.
What is the InChIKey of 2-(4-dibenzofuran-4-yldibenzofuran-1-yl)-4-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-2-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-6-(3,5-diphenylphenyl)-2-phenylpyrimidine;2-(1-dibenzofuran-2-yldibenzofuran-4-yl)-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;2-[4-(1-dibenzofuran-3-yldibenzofuran-4-yl)phenyl]-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;4-[4-(4-dibenzothiophen-4-yldibenzofuran-1-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine?
The InChIKey is ANJRGVFVAUCAAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H35N3O2.3C52H32N2O2.C52H32N2OS.C51H31N3O2/c1-4-14-36(15-5-1)42-32-43(37-16-6-2-7-17-37)34-44(33-42)57-59-55(39-18-8-3-9-19-39)58-56(60-57)40-26-24-38(25-27-40)46-31-30-45(53-49-21-11-13-23-51(49)62-54(46)53)41-28-29-48-47-20-10-12-22-50(47)61-52(48)35-41;1-4-15-33(16-5-1)36-29-37(34-17-6-2-7-18-34)31-38(30-36)45-32-46(54-52(53-45)35-19-8-3-9-20-35)43-28-27-42(51-49(43)44-22-11-13-26-48(44)56-51)41-24-14-23-40-39-21-10-12-25-47(39)55-50(40)41;1-4-15-33(16-5-1)36-29-37(34-17-6-2-7-18-34)31-38(30-36)52-53-45(35-19-8-3-9-20-35)32-46(54-52)43-28-27-42(51-49(43)44-22-11-13-26-48(44)56-51)41-24-14-23-40-39-21-10-12-25-47(39)55-50(40)41;1-4-15-33(16-5-1)36-29-37(34-17-6-2-7-18-34)31-38(30-36)46-32-45(35-19-8-3-9-20-35)53-52(54-46)44-28-27-42(51-49(44)43-22-11-13-26-48(43)56-51)41-24-14-23-40-39-21-10-12-25-47(39)55-50(40)41;1-3-12-33(13-4-1)34-22-26-36(27-23-34)45-32-46(54-52(53-45)38-14-5-2-6-15-38)37-28-24-35(25-29-37)39-30-31-41(50-49(39)44-17-7-9-20-47(44)55-50)43-19-11-18-42-40-16-8-10-21-48(40)56-51(42)43;1-4-14-32(15-5-1)36-28-37(33-16-6-2-7-17-33)30-38(29-36)50-52-49(34-18-8-3-9-19-34)53-51(54-50)42-26-25-39(47-41-21-11-13-23-45(41)56-48(42)47)35-24-27-46-43(31-35)40-20-10-12-22-44(40)55-46/h1-35H;4*1-32H;1-31H.
What are the key properties of 2-(4-dibenzofuran-4-yldibenzofuran-1-yl)-4-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-2-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-6-(3,5-diphenylphenyl)-2-phenylpyrimidine;2-(1-dibenzofuran-2-yldibenzofuran-4-yl)-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;2-[4-(1-dibenzofuran-3-yldibenzofuran-4-yl)phenyl]-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;4-[4-(4-dibenzothiophen-4-yldibenzofuran-1-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine?
2-(4-dibenzofuran-4-yldibenzofuran-1-yl)-4-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-2-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-6-(3,5-diphenylphenyl)-2-phenylpyrimidine;2-(1-dibenzofuran-2-yldibenzofuran-4-yl)-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;2-[4-(1-dibenzofuran-3-yldibenzofuran-4-yl)phenyl]-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;4-[4-(4-dibenzothiophen-4-yldibenzofuran-1-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine has a molecular weight of 4395.18 g/mol, XLogP of 86.59, 37 rotatable bonds, 0 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-dibenzofuran-4-yldibenzofuran-1-yl)-4-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-2-(3,5-diphenylphenyl)-6-phenylpyrimidine;4-(4-dibenzofuran-4-yldibenzofuran-1-yl)-6-(3,5-diphenylphenyl)-2-phenylpyrimidine;2-(1-dibenzofuran-2-yldibenzofuran-4-yl)-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;2-[4-(1-dibenzofuran-3-yldibenzofuran-4-yl)phenyl]-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine;4-[4-(4-dibenzothiophen-4-yldibenzofuran-1-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine is sourced from PubChem (CID 157170313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).