2,7-bis(4-methoxyphenyl)-9,10-diphenylanthracene;2,7-bis(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;3-(9,10-diphenyl-7-pyridin-3-ylanthracen-2-yl)pyridine;3-[6-[9,10-diphenyl-7-(6-pyridin-3-ylpyren-1-yl)anthracen-2-yl]pyren-1-yl]pyridine;4-(9,10-diphenyl-7-quinolin-4-ylanthracen-2-yl)quinoline;5-(9,10-diphenyl-7-quinolin-5-ylanthracen-2-yl)quinoline;2-(9,10-diphenyl-7-thiophen-2-ylanthracen-2-yl)thiophene;2-[4-[9,10-diphenyl-7-(4-thiophen-2-ylnaphthalen-1-yl)anthracen-2-yl]naphthalen-1-yl]thiophene

C378H244N8O2S4 — CID 158056299

IUPAC2,7-bis(4-methoxyphenyl)-9,10-diphenylanthracene;2,7-bis(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;3-(9,10-diphenyl-7-pyridin-3-ylanthracen-2-yl)pyridine;3-[6-[9,10-diphenyl-7-(6-pyridin-3-ylpyren-1-yl)anthracen-2-yl]pyren-1-yl]pyridine;4-(9,10-diphenyl-7-quinolin-4-ylanthracen-2-yl)quinoline;5-(9,10-diphenyl-7-quinolin-5-ylanthracen-2-yl)quinoline;2-(9,10-diphenyl-7-thiophen-2-ylanthracen-2-yl)thiophene;2-[4-[9,10-diphenyl-7-(4-thiophen-2-ylnaphthalen-1-yl)anthracen-2-yl]naphthalen-1-yl]thiophene
SMILESCOc1ccc(-c2ccc3c(-c4ccccc4)c4ccc(-c5ccc(OC)cc5)cc4c(-c4ccccc4)c3c2)cc1.c1ccc(-c2c3ccc(-c4ccc(-c5cccc6ccccc56)cc4)cc3c(-c3ccccc3)c3cc(-c4ccc(-c5cccc6ccccc56)cc4)ccc23)cc1.c1ccc(-c2c3ccc(-c4ccc(-c5cccs5)c5ccccc45)cc3c(-c3ccccc3)c3cc(-c4ccc(-c5cccs5)c5ccccc45)ccc23)cc1.c1ccc(-c2c3ccc(-c4ccc5ccc6c(-c7cccnc7)ccc7ccc4c5c76)cc3c(-c3ccccc3)c3cc(-c4ccc5ccc6c(-c7cccnc7)ccc7ccc4c5c76)ccc23)cc1.c1ccc(-c2c3ccc(-c4cccc5ncccc45)cc3c(-c3ccccc3)c3cc(-c4cccc5ncccc45)ccc23)cc1.c1ccc(-c2c3ccc(-c4cccnc4)cc3c(-c3ccccc3)c3cc(-c4cccnc4)ccc23)cc1.c1ccc(-c2c3ccc(-c4cccs4)cc3c(-c3ccccc3)c3cc(-c4cccs4)ccc23)cc1.c1ccc(-c2c3ccc(-c4ccnc5ccccc45)cc3c(-c3ccccc3)c3cc(-c4ccnc5ccccc45)ccc23)cc1
InChIInChI=1S/C68H40N2.C58H38.C54H34S2.2C44H28N2.C40H30O2.C36H24N2.C34H22S2/c1-3-9-41(10-4-1)63-59-33-23-47(51-25-15-43-21-31-57-53(49-13-7-35-69-39-49)27-17-45-19-29-55(51)65(43)67(45)57)37-61(59)64(42-11-5-2-6-12-42)62-38-48(24-34-60(62)63)52-26-16-44-22-32-58-54(50-14-8-36-70-40-50)28-18-46-20-30-56(52)66(44)68(46)58;1-3-15-45(16-4-1)57-53-35-33-47(39-25-29-43(30-26-39)51-23-11-19-41-13-7-9-21-49(41)51)37-55(53)58(46-17-5-2-6-18-46)56-38-48(34-36-54(56)57)40-27-31-44(32-28-40)52-24-12-20-42-14-8-10-22-50(42)52;1-3-13-35(14-4-1)53-47-25-23-37(39-27-29-45(51-21-11-31-55-51)43-19-9-7-17-41(39)43)33-49(47)54(36-15-5-2-6-16-36)50-34-38(24-26-48(50)53)40-28-30-46(52-22-12-32-56-52)44-20-10-8-18-42(40)44;1-3-11-29(12-4-1)43-37-23-21-31(33-15-7-19-41-35(33)17-9-25-45-41)27-39(37)44(30-13-5-2-6-14-30)40-28-32(22-24-38(40)43)34-16-8-20-42-36(34)18-10-26-46-42;1-3-11-29(12-4-1)43-37-21-19-31(33-23-25-45-41-17-9-7-15-35(33)41)27-39(37)44(30-13-5-2-6-14-30)40-28-32(20-22-38(40)43)34-24-26-46-42-18-10-8-16-36(34)42;1-41-33-19-13-27(14-20-33)31-17-23-35-37(25-31)40(30-11-7-4-8-12-30)38-26-32(28-15-21-34(42-2)22-16-28)18-24-36(38)39(35)29-9-5-3-6-10-29;1-3-9-25(10-4-1)35-31-17-15-27(29-13-7-19-37-23-29)21-33(31)36(26-11-5-2-6-12-26)34-22-28(16-18-32(34)35)30-14-8-20-38-24-30;1-3-9-23(10-4-1)33-27-17-15-25(31-13-7-19-35-31)21-29(27)34(24-11-5-2-6-12-24)30-22-26(16-18-28(30)33)32-14-8-20-36-32/h1-40H;1-38H;1-34H;2*1-28H;3-26H,1-2H3;1-24H;1-22H
InChIKeyFKCCGPMYDWLDLT-UHFFFAOYSA-N
MW5058.43 g/mol
LogP105.73
Rot. Bonds40

About 2,7-bis(4-methoxyphenyl)-9,10-diphenylanthracene;2,7-bis(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;3-(9,10-diphenyl-7-pyridin-3-ylanthracen-2-yl)pyridine;3-[6-[9,10-diphenyl-7-(6-pyridin-3-ylpyren-1-yl)anthracen-2-yl]pyren-1-yl]pyridine;4-(9,10-diphenyl-7-quinolin-4-ylanthracen-2-yl)quinoline;5-(9,10-diphenyl-7-quinolin-5-ylanthracen-2-yl)quinoline;2-(9,10-diphenyl-7-thiophen-2-ylanthracen-2-yl)thiophene;2-[4-[9,10-diphenyl-7-(4-thiophen-2-ylnaphthalen-1-yl)anthracen-2-yl]naphthalen-1-yl]thiophene

2,7-bis(4-methoxyphenyl)-9,10-diphenylanthracene;2,7-bis(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;3-(9,10-diphenyl-7-pyridin-3-ylanthracen-2-yl)pyridine;3-[6-[9,10-diphenyl-7-(6-pyridin-3-ylpyren-1-yl)anthracen-2-yl]pyren-1-yl]pyridine;4-(9,10-diphenyl-7-quinolin-4-ylanthracen-2-yl)quinoline;5-(9,10-diphenyl-7-quinolin-5-ylanthracen-2-yl)quinoline;2-(9,10-diphenyl-7-thiophen-2-ylanthracen-2-yl)thiophene;2-[4-[9,10-diphenyl-7-(4-thiophen-2-ylnaphthalen-1-yl)anthracen-2-yl]naphthalen-1-yl]thiophene (PubChem CID 158056299) has the molecular formula C378H244N8O2S4 and a molecular weight of 5058.43 g/mol. Its IUPAC name is 2,7-bis(4-methoxyphenyl)-9,10-diphenylanthracene;2,7-bis(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;3-(9,10-diphenyl-7-pyridin-3-ylanthracen-2-yl)pyridine;3-[6-[9,10-diphenyl-7-(6-pyridin-3-ylpyren-1-yl)anthracen-2-yl]pyren-1-yl]pyridine;4-(9,10-diphenyl-7-quinolin-4-ylanthracen-2-yl)quinoline;5-(9,10-diphenyl-7-quinolin-5-ylanthracen-2-yl)quinoline;2-(9,10-diphenyl-7-thiophen-2-ylanthracen-2-yl)thiophene;2-[4-[9,10-diphenyl-7-(4-thiophen-2-ylnaphthalen-1-yl)anthracen-2-yl]naphthalen-1-yl]thiophene.

Molecular Properties

Compound Name2,7-bis(4-methoxyphenyl)-9,10-diphenylanthracene;2,7-bis(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;3-(9,10-diphenyl-7-pyridin-3-ylanthracen-2-yl)pyridine;3-[6-[9,10-diphenyl-7-(6-pyridin-3-ylpyren-1-yl)anthracen-2-yl]pyren-1-yl]pyridine;4-(9,10-diphenyl-7-quinolin-4-ylanthracen-2-yl)quinoline;5-(9,10-diphenyl-7-quinolin-5-ylanthracen-2-yl)quinoline;2-(9,10-diphenyl-7-thiophen-2-ylanthracen-2-yl)thiophene;2-[4-[9,10-diphenyl-7-(4-thiophen-2-ylnaphthalen-1-yl)anthracen-2-yl]naphthalen-1-yl]thiophene
PubChem CID158056299
Molecular FormulaC378H244N8O2S4
Molecular Weight5058.43 g/mol
Exact Mass5053.81
IUPAC Name2,7-bis(4-methoxyphenyl)-9,10-diphenylanthracene;2,7-bis(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;3-(9,10-diphenyl-7-pyridin-3-ylanthracen-2-yl)pyridine;3-[6-[9,10-diphenyl-7-(6-pyridin-3-ylpyren-1-yl)anthracen-2-yl]pyren-1-yl]pyridine;4-(9,10-diphenyl-7-quinolin-4-ylanthracen-2-yl)quinoline;5-(9,10-diphenyl-7-quinolin-5-ylanthracen-2-yl)quinoline;2-(9,10-diphenyl-7-thiophen-2-ylanthracen-2-yl)thiophene;2-[4-[9,10-diphenyl-7-(4-thiophen-2-ylnaphthalen-1-yl)anthracen-2-yl]naphthalen-1-yl]thiophene
SMILESCOc1ccc(-c2ccc3c(-c4ccccc4)c4ccc(-c5ccc(OC)cc5)cc4c(-c4ccccc4)c3c2)cc1.c1ccc(-c2c3ccc(-c4ccc(-c5cccc6ccccc56)cc4)cc3c(-c3ccccc3)c3cc(-c4ccc(-c5cccc6ccccc56)cc4)ccc23)cc1.c1ccc(-c2c3ccc(-c4ccc(-c5cccs5)c5ccccc45)cc3c(-c3ccccc3)c3cc(-c4ccc(-c5cccs5)c5ccccc45)ccc23)cc1.c1ccc(-c2c3ccc(-c4ccc5ccc6c(-c7cccnc7)ccc7ccc4c5c76)cc3c(-c3ccccc3)c3cc(-c4ccc5ccc6c(-c7cccnc7)ccc7ccc4c5c76)ccc23)cc1.c1ccc(-c2c3ccc(-c4cccc5ncccc45)cc3c(-c3ccccc3)c3cc(-c4cccc5ncccc45)ccc23)cc1.c1ccc(-c2c3ccc(-c4cccnc4)cc3c(-c3ccccc3)c3cc(-c4cccnc4)ccc23)cc1.c1ccc(-c2c3ccc(-c4cccs4)cc3c(-c3ccccc3)c3cc(-c4cccs4)ccc23)cc1.c1ccc(-c2c3ccc(-c4ccnc5ccccc45)cc3c(-c3ccccc3)c3cc(-c4ccnc5ccccc45)ccc23)cc1
InChIInChI=1S/C68H40N2.C58H38.C54H34S2.2C44H28N2.C40H30O2.C36H24N2.C34H22S2/c1-3-9-41(10-4-1)63-59-33-23-47(51-25-15-43-21-31-57-53(49-13-7-35-69-39-49)27-17-45-19-29-55(51)65(43)67(45)57)37-61(59)64(42-11-5-2-6-12-42)62-38-48(24-34-60(62)63)52-26-16-44-22-32-58-54(50-14-8-36-70-40-50)28-18-46-20-30-56(52)66(44)68(46)58;1-3-15-45(16-4-1)57-53-35-33-47(39-25-29-43(30-26-39)51-23-11-19-41-13-7-9-21-49(41)51)37-55(53)58(46-17-5-2-6-18-46)56-38-48(34-36-54(56)57)40-27-31-44(32-28-40)52-24-12-20-42-14-8-10-22-50(42)52;1-3-13-35(14-4-1)53-47-25-23-37(39-27-29-45(51-21-11-31-55-51)43-19-9-7-17-41(39)43)33-49(47)54(36-15-5-2-6-16-36)50-34-38(24-26-48(50)53)40-28-30-46(52-22-12-32-56-52)44-20-10-8-18-42(40)44;1-3-11-29(12-4-1)43-37-23-21-31(33-15-7-19-41-35(33)17-9-25-45-41)27-39(37)44(30-13-5-2-6-14-30)40-28-32(22-24-38(40)43)34-16-8-20-42-36(34)18-10-26-46-42;1-3-11-29(12-4-1)43-37-21-19-31(33-23-25-45-41-17-9-7-15-35(33)41)27-39(37)44(30-13-5-2-6-14-30)40-28-32(20-22-38(40)43)34-24-26-46-42-18-10-8-16-36(34)42;1-41-33-19-13-27(14-20-33)31-17-23-35-37(25-31)40(30-11-7-4-8-12-30)38-26-32(28-15-21-34(42-2)22-16-28)18-24-36(38)39(35)29-9-5-3-6-10-29;1-3-9-25(10-4-1)35-31-17-15-27(29-13-7-19-37-23-29)21-33(31)36(26-11-5-2-6-12-26)34-22-28(16-18-32(34)35)30-14-8-20-38-24-30;1-3-9-23(10-4-1)33-27-17-15-25(31-13-7-19-35-31)21-29(27)34(24-11-5-2-6-12-24)30-22-26(16-18-28(30)33)32-14-8-20-36-32/h1-40H;1-38H;1-34H;2*1-28H;3-26H,1-2H3;1-24H;1-22H
InChIKeyFKCCGPMYDWLDLT-UHFFFAOYSA-N
XLogP105.73
TPSA121.58 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds40
Heavy Atoms392
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005058.43
LogP ≤ 5105.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 2,7-bis(4-methoxyphenyl)-9,10-diphenylanthracene;2,7-bis(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;3-(9,10-diphenyl-7-pyridin-3-ylanthracen-2-yl)pyridine;3-[6-[9,10-diphenyl-7-(6-pyridin-3-ylpyren-1-yl)anthracen-2-yl]pyren-1-yl]pyridine;4-(9,10-diphenyl-7-quinolin-4-ylanthracen-2-yl)quinoline;5-(9,10-diphenyl-7-quinolin-5-ylanthracen-2-yl)quinoline;2-(9,10-diphenyl-7-thiophen-2-ylanthracen-2-yl)thiophene;2-[4-[9,10-diphenyl-7-(4-thiophen-2-ylnaphthalen-1-yl)anthracen-2-yl]naphthalen-1-yl]thiophene with MolForge

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Related Compounds

2-[3,3,4,4,5,5-Hexafluoro-2-[5-(4-methoxyphenyl)-3-methylthiophen-2-yl]cyclopenten-1-yl]-3-methyl-5-(4-phenylphenyl)thiophene;2-[3,3,4,4,5,5-hexafluoro-2-(3-methylthieno[3,2-g]quinolin-2-yl)cyclopenten-1-yl]-3-methylthieno[3,2-g]quinoline
CID 91163099
CID 158077388
CID 158077388
CID 158222162
CID 158222162
CID 160019839
CID 160019839
2-[3,3,4,4,5,5-Hexafluoro-2-[5-(4-methoxyphenyl)-3-methylthiophen-2-yl]cyclopenten-1-yl]-3-methyl-5-(4-phenylphenyl)thiophene;2-[3,3,4,4,5,5-hexafluoro-2-(3-methylbenzo[f][1]benzothiol-2-yl)cyclopenten-1-yl]-3-methylbenzo[f][1]benzothiole;2-[3,3,4,4,5,5-hexafluoro-2-(3-methylthieno[2,3-b]pyridin-2-yl)cyclopenten-1-yl]-3-methylthieno[2,3-b]pyridine;2-[3,3,4,4,5,5-hexafluoro-2-(3-methylthieno[3,2-g]quinolin-2-yl)cyclopenten-1-yl]-3-methylthieno[3,2-g]quinoline
CID 160115705
3-[5-[4-[3,3,4,4,5,5-Hexafluoro-2-[5-(3-isoquinolin-3-yl-4-methoxyphenyl)thiophen-3-yl]cyclopenten-1-yl]thiophen-2-yl]-2-methoxyphenyl]isoquinoline
CID 166754530
8-Methoxy-5-[5-[4-[5-(8-methoxyquinolin-5-yl)thiophen-2-yl]phenyl]thiophen-2-yl]quinoline
CID 16081247
12-(4-Methoxyphenyl)-5-phenyl-11-(3-pyridin-3-ylphenyl)-23-thia-5-azahexacyclo[11.11.0.02,10.04,8.016,24.017,22]tetracosa-1(13),2(10),3,6,8,11,14,16(24),17,19,21-undecaene
CID 117878485
10-[5-[8-[5-[5-(5-Phenoxazin-10-ylthiophen-2-yl)benzo[g]quinoxalin-10-yl]thiophen-2-yl]quinoxalin-5-yl]thiophen-2-yl]phenoxazine
CID 138489048
3-(6H-benzo[c]chromen-10-yl)-6-[4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-3,6-dimethylcyclohexen-1-yl]-[1]benzothiolo[2,3-c]quinoline
CID 146489155
2-[18-[1-[18-[1-[14,22-Bis(4-methoxyphenyl)-18-methyl-9-hexacyclo[14.6.2.02,11.03,8.013,23.020,24]tetracosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaenyl]-2-methylpropan-2-yl]-14,22-dithiophen-2-yl-9-hexacyclo[14.6.2.02,11.03,8.013,23.020,24]tetracosa-1,3,5,7,9,11,13(23),14,16,18,20(24),21-dodecaenyl]-2-methylpropan-2-yl]-14-pyridin-2-yl-22-hexacyclo[14.6.2.02,11.03,8.013,23.020,24]tetracosa-1,3,5,7,9,11,13(23),14,16,18,20(24),21-dodecaenyl]pyridine
CID 156035191
4,20-bis(1-benzothiophen-3-yl)-12-thia-7,17-diazapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;4,20-bis(9-phenylcarbazol-3-yl)-12-thia-7,17-diazapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;N,N-diphenyl-4-[20-[4-(N-phenylanilino)phenyl]-12-thia-7,17-diazapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaen-4-yl]aniline;4,20-dipyridin-3-yl-12-thia-7,17-diazapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;4-(4-methoxyphenyl)-20-(4-methylphenyl)-12-thia-7,17-diazapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene
CID 157065891

Frequently Asked Questions

What is the IUPAC name of 2,7-bis(4-methoxyphenyl)-9,10-diphenylanthracene;2,7-bis(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;3-(9,10-diphenyl-7-pyridin-3-ylanthracen-2-yl)pyridine;3-[6-[9,10-diphenyl-7-(6-pyridin-3-ylpyren-1-yl)anthracen-2-yl]pyren-1-yl]pyridine;4-(9,10-diphenyl-7-quinolin-4-ylanthracen-2-yl)quinoline;5-(9,10-diphenyl-7-quinolin-5-ylanthracen-2-yl)quinoline;2-(9,10-diphenyl-7-thiophen-2-ylanthracen-2-yl)thiophene;2-[4-[9,10-diphenyl-7-(4-thiophen-2-ylnaphthalen-1-yl)anthracen-2-yl]naphthalen-1-yl]thiophene?
The IUPAC name of 2,7-bis(4-methoxyphenyl)-9,10-diphenylanthracene;2,7-bis(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;3-(9,10-diphenyl-7-pyridin-3-ylanthracen-2-yl)pyridine;3-[6-[9,10-diphenyl-7-(6-pyridin-3-ylpyren-1-yl)anthracen-2-yl]pyren-1-yl]pyridine;4-(9,10-diphenyl-7-quinolin-4-ylanthracen-2-yl)quinoline;5-(9,10-diphenyl-7-quinolin-5-ylanthracen-2-yl)quinoline;2-(9,10-diphenyl-7-thiophen-2-ylanthracen-2-yl)thiophene;2-[4-[9,10-diphenyl-7-(4-thiophen-2-ylnaphthalen-1-yl)anthracen-2-yl]naphthalen-1-yl]thiophene (CID 158056299) is 2,7-bis(4-methoxyphenyl)-9,10-diphenylanthracene;2,7-bis(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;3-(9,10-diphenyl-7-pyridin-3-ylanthracen-2-yl)pyridine;3-[6-[9,10-diphenyl-7-(6-pyridin-3-ylpyren-1-yl)anthracen-2-yl]pyren-1-yl]pyridine;4-(9,10-diphenyl-7-quinolin-4-ylanthracen-2-yl)quinoline;5-(9,10-diphenyl-7-quinolin-5-ylanthracen-2-yl)quinoline;2-(9,10-diphenyl-7-thiophen-2-ylanthracen-2-yl)thiophene;2-[4-[9,10-diphenyl-7-(4-thiophen-2-ylnaphthalen-1-yl)anthracen-2-yl]naphthalen-1-yl]thiophene.
What is the SMILES notation for 2,7-bis(4-methoxyphenyl)-9,10-diphenylanthracene;2,7-bis(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;3-(9,10-diphenyl-7-pyridin-3-ylanthracen-2-yl)pyridine;3-[6-[9,10-diphenyl-7-(6-pyridin-3-ylpyren-1-yl)anthracen-2-yl]pyren-1-yl]pyridine;4-(9,10-diphenyl-7-quinolin-4-ylanthracen-2-yl)quinoline;5-(9,10-diphenyl-7-quinolin-5-ylanthracen-2-yl)quinoline;2-(9,10-diphenyl-7-thiophen-2-ylanthracen-2-yl)thiophene;2-[4-[9,10-diphenyl-7-(4-thiophen-2-ylnaphthalen-1-yl)anthracen-2-yl]naphthalen-1-yl]thiophene?
The canonical SMILES for 2,7-bis(4-methoxyphenyl)-9,10-diphenylanthracene;2,7-bis(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;3-(9,10-diphenyl-7-pyridin-3-ylanthracen-2-yl)pyridine;3-[6-[9,10-diphenyl-7-(6-pyridin-3-ylpyren-1-yl)anthracen-2-yl]pyren-1-yl]pyridine;4-(9,10-diphenyl-7-quinolin-4-ylanthracen-2-yl)quinoline;5-(9,10-diphenyl-7-quinolin-5-ylanthracen-2-yl)quinoline;2-(9,10-diphenyl-7-thiophen-2-ylanthracen-2-yl)thiophene;2-[4-[9,10-diphenyl-7-(4-thiophen-2-ylnaphthalen-1-yl)anthracen-2-yl]naphthalen-1-yl]thiophene is COc1ccc(-c2ccc3c(-c4ccccc4)c4ccc(-c5ccc(OC)cc5)cc4c(-c4ccccc4)c3c2)cc1.c1ccc(-c2c3ccc(-c4ccc(-c5cccc6ccccc56)cc4)cc3c(-c3ccccc3)c3cc(-c4ccc(-c5cccc6ccccc56)cc4)ccc23)cc1.c1ccc(-c2c3ccc(-c4ccc(-c5cccs5)c5ccccc45)cc3c(-c3ccccc3)c3cc(-c4ccc(-c5cccs5)c5ccccc45)ccc23)cc1.c1ccc(-c2c3ccc(-c4ccc5ccc6c(-c7cccnc7)ccc7ccc4c5c76)cc3c(-c3ccccc3)c3cc(-c4ccc5ccc6c(-c7cccnc7)ccc7ccc4c5c76)ccc23)cc1.c1ccc(-c2c3ccc(-c4cccc5ncccc45)cc3c(-c3ccccc3)c3cc(-c4cccc5ncccc45)ccc23)cc1.c1ccc(-c2c3ccc(-c4cccnc4)cc3c(-c3ccccc3)c3cc(-c4cccnc4)ccc23)cc1.c1ccc(-c2c3ccc(-c4cccs4)cc3c(-c3ccccc3)c3cc(-c4cccs4)ccc23)cc1.c1ccc(-c2c3ccc(-c4ccnc5ccccc45)cc3c(-c3ccccc3)c3cc(-c4ccnc5ccccc45)ccc23)cc1.
What is the InChIKey of 2,7-bis(4-methoxyphenyl)-9,10-diphenylanthracene;2,7-bis(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;3-(9,10-diphenyl-7-pyridin-3-ylanthracen-2-yl)pyridine;3-[6-[9,10-diphenyl-7-(6-pyridin-3-ylpyren-1-yl)anthracen-2-yl]pyren-1-yl]pyridine;4-(9,10-diphenyl-7-quinolin-4-ylanthracen-2-yl)quinoline;5-(9,10-diphenyl-7-quinolin-5-ylanthracen-2-yl)quinoline;2-(9,10-diphenyl-7-thiophen-2-ylanthracen-2-yl)thiophene;2-[4-[9,10-diphenyl-7-(4-thiophen-2-ylnaphthalen-1-yl)anthracen-2-yl]naphthalen-1-yl]thiophene?
The InChIKey is FKCCGPMYDWLDLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H40N2.C58H38.C54H34S2.2C44H28N2.C40H30O2.C36H24N2.C34H22S2/c1-3-9-41(10-4-1)63-59-33-23-47(51-25-15-43-21-31-57-53(49-13-7-35-69-39-49)27-17-45-19-29-55(51)65(43)67(45)57)37-61(59)64(42-11-5-2-6-12-42)62-38-48(24-34-60(62)63)52-26-16-44-22-32-58-54(50-14-8-36-70-40-50)28-18-46-20-30-56(52)66(44)68(46)58;1-3-15-45(16-4-1)57-53-35-33-47(39-25-29-43(30-26-39)51-23-11-19-41-13-7-9-21-49(41)51)37-55(53)58(46-17-5-2-6-18-46)56-38-48(34-36-54(56)57)40-27-31-44(32-28-40)52-24-12-20-42-14-8-10-22-50(42)52;1-3-13-35(14-4-1)53-47-25-23-37(39-27-29-45(51-21-11-31-55-51)43-19-9-7-17-41(39)43)33-49(47)54(36-15-5-2-6-16-36)50-34-38(24-26-48(50)53)40-28-30-46(52-22-12-32-56-52)44-20-10-8-18-42(40)44;1-3-11-29(12-4-1)43-37-23-21-31(33-15-7-19-41-35(33)17-9-25-45-41)27-39(37)44(30-13-5-2-6-14-30)40-28-32(22-24-38(40)43)34-16-8-20-42-36(34)18-10-26-46-42;1-3-11-29(12-4-1)43-37-21-19-31(33-23-25-45-41-17-9-7-15-35(33)41)27-39(37)44(30-13-5-2-6-14-30)40-28-32(20-22-38(40)43)34-24-26-46-42-18-10-8-16-36(34)42;1-41-33-19-13-27(14-20-33)31-17-23-35-37(25-31)40(30-11-7-4-8-12-30)38-26-32(28-15-21-34(42-2)22-16-28)18-24-36(38)39(35)29-9-5-3-6-10-29;1-3-9-25(10-4-1)35-31-17-15-27(29-13-7-19-37-23-29)21-33(31)36(26-11-5-2-6-12-26)34-22-28(16-18-32(34)35)30-14-8-20-38-24-30;1-3-9-23(10-4-1)33-27-17-15-25(31-13-7-19-35-31)21-29(27)34(24-11-5-2-6-12-24)30-22-26(16-18-28(30)33)32-14-8-20-36-32/h1-40H;1-38H;1-34H;2*1-28H;3-26H,1-2H3;1-24H;1-22H.
What are the key properties of 2,7-bis(4-methoxyphenyl)-9,10-diphenylanthracene;2,7-bis(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;3-(9,10-diphenyl-7-pyridin-3-ylanthracen-2-yl)pyridine;3-[6-[9,10-diphenyl-7-(6-pyridin-3-ylpyren-1-yl)anthracen-2-yl]pyren-1-yl]pyridine;4-(9,10-diphenyl-7-quinolin-4-ylanthracen-2-yl)quinoline;5-(9,10-diphenyl-7-quinolin-5-ylanthracen-2-yl)quinoline;2-(9,10-diphenyl-7-thiophen-2-ylanthracen-2-yl)thiophene;2-[4-[9,10-diphenyl-7-(4-thiophen-2-ylnaphthalen-1-yl)anthracen-2-yl]naphthalen-1-yl]thiophene?
2,7-bis(4-methoxyphenyl)-9,10-diphenylanthracene;2,7-bis(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;3-(9,10-diphenyl-7-pyridin-3-ylanthracen-2-yl)pyridine;3-[6-[9,10-diphenyl-7-(6-pyridin-3-ylpyren-1-yl)anthracen-2-yl]pyren-1-yl]pyridine;4-(9,10-diphenyl-7-quinolin-4-ylanthracen-2-yl)quinoline;5-(9,10-diphenyl-7-quinolin-5-ylanthracen-2-yl)quinoline;2-(9,10-diphenyl-7-thiophen-2-ylanthracen-2-yl)thiophene;2-[4-[9,10-diphenyl-7-(4-thiophen-2-ylnaphthalen-1-yl)anthracen-2-yl]naphthalen-1-yl]thiophene has a molecular weight of 5058.43 g/mol, XLogP of 105.73, 40 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-bis(4-methoxyphenyl)-9,10-diphenylanthracene;2,7-bis(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;3-(9,10-diphenyl-7-pyridin-3-ylanthracen-2-yl)pyridine;3-[6-[9,10-diphenyl-7-(6-pyridin-3-ylpyren-1-yl)anthracen-2-yl]pyren-1-yl]pyridine;4-(9,10-diphenyl-7-quinolin-4-ylanthracen-2-yl)quinoline;5-(9,10-diphenyl-7-quinolin-5-ylanthracen-2-yl)quinoline;2-(9,10-diphenyl-7-thiophen-2-ylanthracen-2-yl)thiophene;2-[4-[9,10-diphenyl-7-(4-thiophen-2-ylnaphthalen-1-yl)anthracen-2-yl]naphthalen-1-yl]thiophene is sourced from PubChem (CID 158056299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).