5-[2,7-ditert-butyl-9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-(2-methylphenyl)-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-naphthalen-1-yl-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]-N,N-diphenylfuran-2-amine;2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)-1,3-oxazol-2-yl]pyren-4-yl]-N,N-diphenyl-1,3-oxazol-5-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)thiophen-2-yl]pyren-4-yl]-N,N-diphenylthiophen-2-amine;N,N-diphenyl-5-[9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]furan-2-amine;N-(2-methylphenyl)-5-[9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine;N-naphthalen-1-yl-5-[9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine

C442H350N18O14S2 — CID 157202563

IUPAC5-[2,7-ditert-butyl-9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-(2-methylphenyl)-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-naphthalen-1-yl-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]-N,N-diphenylfuran-2-amine;2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)-1,3-oxazol-2-yl]pyren-4-yl]-N,N-diphenyl-1,3-oxazol-5-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)thiophen-2-yl]pyren-4-yl]-N,N-diphenylthiophen-2-amine;N,N-diphenyl-5-[9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]furan-2-amine;N-(2-methylphenyl)-5-[9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine;N-naphthalen-1-yl-5-[9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine
SMILESCC(C)(C)c1cc2cc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)o3)c3cc(C(C)(C)C)cc4cc(-c5ccc(N(c6ccccc6)c6cccc7ccccc67)o5)c(c1)c2c43.CC(C)(C)c1cc2cc(-c3ccc(N(c4ccccc4)c4ccccc4)o3)c3cc(C(C)(C)C)cc4cc(-c5ccc(N(c6ccccc6)c6ccccc6)o5)c(c1)c2c43.CC(C)(C)c1cc2cc(-c3ccc(N(c4ccccc4)c4ccccc4)s3)c3cc(C(C)(C)C)cc4cc(-c5ccc(N(c6ccccc6)c6ccccc6)s5)c(c1)c2c43.CC(C)(C)c1cc2cc(-c3ncc(N(c4ccccc4)c4ccccc4)o3)c3cc(C(C)(C)C)cc4cc(-c5ncc(N(c6ccccc6)c6ccccc6)o5)c(c1)c2c43.Cc1ccccc1N(c1ccccc1)c1ccc(-c2cc3cc(C(C)(C)C)cc4c(-c5ccc(N(c6ccccc6)c6ccccc6C)o5)cc5cc(C(C)(C)C)cc2c5c34)o1.Cc1ccccc1N(c1ccccc1)c1ccc(-c2cc3cccc4c(-c5ccc(N(c6ccccc6)c6ccccc6C)o5)cc5cccc2c5c34)o1.c1ccc(N(c2ccc(-c3cc4cccc5c(-c6ccc(N(c7ccccc7)c7cccc8ccccc78)o6)cc6cccc3c6c45)o2)c2cccc3ccccc23)cc1.c1ccc(N(c2ccccc2)c2ccc(-c3cc4cccc5c(-c6ccc(N(c7ccccc7)c7ccccc7)o6)cc6cccc3c6c45)o2)cc1
InChIInChI=1S/C64H52N2O2.C58H52N2O2.C56H36N2O2.C56H48N2O2.C56H48N2S2.C54H46N4O2.C50H36N2O2.C48H32N2O2/c1-63(2,3)45-35-43-37-52(58-32-34-60(68-58)66(48-25-11-8-12-26-48)56-30-18-22-42-20-14-16-28-50(42)56)54-40-46(64(4,5)6)36-44-38-51(53(39-45)61(43)62(44)54)57-31-33-59(67-57)65(47-23-9-7-10-24-47)55-29-17-21-41-19-13-15-27-49(41)55;1-37-19-15-17-25-49(37)59(43-21-11-9-12-22-43)53-29-27-51(61-53)45-33-39-31-42(58(6,7)8)36-48-46(34-40-32-41(57(3,4)5)35-47(45)55(40)56(39)48)52-28-30-54(62-52)60(44-23-13-10-14-24-44)50-26-18-16-20-38(50)2;1-3-21-41(22-4-1)57(49-29-13-17-37-15-7-9-25-43(37)49)53-33-31-51(59-53)47-35-39-19-12-28-46-48(36-40-20-11-27-45(47)55(40)56(39)46)52-32-34-54(60-52)58(42-23-5-2-6-24-42)50-30-14-18-38-16-8-10-26-44(38)50;2*1-55(2,3)39-31-37-33-46(50-28-30-52(60-50)58(43-23-15-9-16-24-43)44-25-17-10-18-26-44)48-36-40(56(4,5)6)32-38-34-45(47(35-39)53(37)54(38)48)49-27-29-51(59-49)57(41-19-11-7-12-20-41)42-21-13-8-14-22-42;1-53(2,3)37-27-35-29-46(52-56-34-48(60-52)58(41-23-15-9-16-24-41)42-25-17-10-18-26-42)44-32-38(54(4,5)6)28-36-30-45(43(31-37)49(35)50(36)44)51-55-33-47(59-51)57(39-19-11-7-12-20-39)40-21-13-8-14-22-40;1-33-15-9-11-25-43(33)51(37-19-5-3-6-20-37)47-29-27-45(53-47)41-31-35-17-14-24-40-42(32-36-18-13-23-39(41)49(36)50(35)40)46-28-30-48(54-46)52(38-21-7-4-8-22-38)44-26-12-10-16-34(44)2;1-5-17-35(18-6-1)49(36-19-7-2-8-20-36)45-29-27-43(51-45)41-31-33-15-14-26-40-42(32-34-16-13-25-39(41)47(34)48(33)40)44-28-30-46(52-44)50(37-21-9-3-10-22-37)38-23-11-4-12-24-38/h7-40H,1-6H3;9-36H,1-8H3;1-36H;2*7-36H,1-6H3;7-34H,1-6H3;3-32H,1-2H3;1-32H
InChIKeyAQYVCIKUKAVMIT-UHFFFAOYSA-N
MW6201.91 g/mol
LogP130.90
Rot. Bonds64

About 5-[2,7-ditert-butyl-9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-(2-methylphenyl)-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-naphthalen-1-yl-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]-N,N-diphenylfuran-2-amine;2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)-1,3-oxazol-2-yl]pyren-4-yl]-N,N-diphenyl-1,3-oxazol-5-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)thiophen-2-yl]pyren-4-yl]-N,N-diphenylthiophen-2-amine;N,N-diphenyl-5-[9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]furan-2-amine;N-(2-methylphenyl)-5-[9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine;N-naphthalen-1-yl-5-[9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine

5-[2,7-ditert-butyl-9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-(2-methylphenyl)-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-naphthalen-1-yl-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]-N,N-diphenylfuran-2-amine;2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)-1,3-oxazol-2-yl]pyren-4-yl]-N,N-diphenyl-1,3-oxazol-5-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)thiophen-2-yl]pyren-4-yl]-N,N-diphenylthiophen-2-amine;N,N-diphenyl-5-[9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]furan-2-amine;N-(2-methylphenyl)-5-[9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine;N-naphthalen-1-yl-5-[9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine (PubChem CID 157202563) has the molecular formula C442H350N18O14S2 and a molecular weight of 6201.91 g/mol. Its IUPAC name is 5-[2,7-ditert-butyl-9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-(2-methylphenyl)-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-naphthalen-1-yl-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]-N,N-diphenylfuran-2-amine;2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)-1,3-oxazol-2-yl]pyren-4-yl]-N,N-diphenyl-1,3-oxazol-5-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)thiophen-2-yl]pyren-4-yl]-N,N-diphenylthiophen-2-amine;N,N-diphenyl-5-[9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]furan-2-amine;N-(2-methylphenyl)-5-[9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine;N-naphthalen-1-yl-5-[9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine.

Molecular Properties

Compound Name5-[2,7-ditert-butyl-9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-(2-methylphenyl)-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-naphthalen-1-yl-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]-N,N-diphenylfuran-2-amine;2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)-1,3-oxazol-2-yl]pyren-4-yl]-N,N-diphenyl-1,3-oxazol-5-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)thiophen-2-yl]pyren-4-yl]-N,N-diphenylthiophen-2-amine;N,N-diphenyl-5-[9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]furan-2-amine;N-(2-methylphenyl)-5-[9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine;N-naphthalen-1-yl-5-[9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine
PubChem CID157202563
Molecular FormulaC442H350N18O14S2
Molecular Weight6201.91 g/mol
Exact Mass6196.67
IUPAC Name5-[2,7-ditert-butyl-9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-(2-methylphenyl)-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-naphthalen-1-yl-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]-N,N-diphenylfuran-2-amine;2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)-1,3-oxazol-2-yl]pyren-4-yl]-N,N-diphenyl-1,3-oxazol-5-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)thiophen-2-yl]pyren-4-yl]-N,N-diphenylthiophen-2-amine;N,N-diphenyl-5-[9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]furan-2-amine;N-(2-methylphenyl)-5-[9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine;N-naphthalen-1-yl-5-[9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine
SMILESCC(C)(C)c1cc2cc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)o3)c3cc(C(C)(C)C)cc4cc(-c5ccc(N(c6ccccc6)c6cccc7ccccc67)o5)c(c1)c2c43.CC(C)(C)c1cc2cc(-c3ccc(N(c4ccccc4)c4ccccc4)o3)c3cc(C(C)(C)C)cc4cc(-c5ccc(N(c6ccccc6)c6ccccc6)o5)c(c1)c2c43.CC(C)(C)c1cc2cc(-c3ccc(N(c4ccccc4)c4ccccc4)s3)c3cc(C(C)(C)C)cc4cc(-c5ccc(N(c6ccccc6)c6ccccc6)s5)c(c1)c2c43.CC(C)(C)c1cc2cc(-c3ncc(N(c4ccccc4)c4ccccc4)o3)c3cc(C(C)(C)C)cc4cc(-c5ncc(N(c6ccccc6)c6ccccc6)o5)c(c1)c2c43.Cc1ccccc1N(c1ccccc1)c1ccc(-c2cc3cc(C(C)(C)C)cc4c(-c5ccc(N(c6ccccc6)c6ccccc6C)o5)cc5cc(C(C)(C)C)cc2c5c34)o1.Cc1ccccc1N(c1ccccc1)c1ccc(-c2cc3cccc4c(-c5ccc(N(c6ccccc6)c6ccccc6C)o5)cc5cccc2c5c34)o1.c1ccc(N(c2ccc(-c3cc4cccc5c(-c6ccc(N(c7ccccc7)c7cccc8ccccc78)o6)cc6cccc3c6c45)o2)c2cccc3ccccc23)cc1.c1ccc(N(c2ccccc2)c2ccc(-c3cc4cccc5c(-c6ccc(N(c7ccccc7)c7ccccc7)o6)cc6cccc3c6c45)o2)cc1
InChIInChI=1S/C64H52N2O2.C58H52N2O2.C56H36N2O2.C56H48N2O2.C56H48N2S2.C54H46N4O2.C50H36N2O2.C48H32N2O2/c1-63(2,3)45-35-43-37-52(58-32-34-60(68-58)66(48-25-11-8-12-26-48)56-30-18-22-42-20-14-16-28-50(42)56)54-40-46(64(4,5)6)36-44-38-51(53(39-45)61(43)62(44)54)57-31-33-59(67-57)65(47-23-9-7-10-24-47)55-29-17-21-41-19-13-15-27-49(41)55;1-37-19-15-17-25-49(37)59(43-21-11-9-12-22-43)53-29-27-51(61-53)45-33-39-31-42(58(6,7)8)36-48-46(34-40-32-41(57(3,4)5)35-47(45)55(40)56(39)48)52-28-30-54(62-52)60(44-23-13-10-14-24-44)50-26-18-16-20-38(50)2;1-3-21-41(22-4-1)57(49-29-13-17-37-15-7-9-25-43(37)49)53-33-31-51(59-53)47-35-39-19-12-28-46-48(36-40-20-11-27-45(47)55(40)56(39)46)52-32-34-54(60-52)58(42-23-5-2-6-24-42)50-30-14-18-38-16-8-10-26-44(38)50;2*1-55(2,3)39-31-37-33-46(50-28-30-52(60-50)58(43-23-15-9-16-24-43)44-25-17-10-18-26-44)48-36-40(56(4,5)6)32-38-34-45(47(35-39)53(37)54(38)48)49-27-29-51(59-49)57(41-19-11-7-12-20-41)42-21-13-8-14-22-42;1-53(2,3)37-27-35-29-46(52-56-34-48(60-52)58(41-23-15-9-16-24-41)42-25-17-10-18-26-42)44-32-38(54(4,5)6)28-36-30-45(43(31-37)49(35)50(36)44)51-55-33-47(59-51)57(39-19-11-7-12-20-39)40-21-13-8-14-22-40;1-33-15-9-11-25-43(33)51(37-19-5-3-6-20-37)47-29-27-45(53-47)41-31-35-17-14-24-40-42(32-36-18-13-23-39(41)49(36)50(35)40)46-28-30-48(54-46)52(38-21-7-4-8-22-38)44-26-12-10-16-34(44)2;1-5-17-35(18-6-1)49(36-19-7-2-8-20-36)45-29-27-43(51-45)41-31-33-15-14-26-40-42(32-34-16-13-25-39(41)47(34)48(33)40)44-28-30-46(52-44)50(37-21-9-3-10-22-37)38-23-11-4-12-24-38/h7-40H,1-6H3;9-36H,1-8H3;1-36H;2*7-36H,1-6H3;7-34H,1-6H3;3-32H,1-2H3;1-32H
InChIKeyAQYVCIKUKAVMIT-UHFFFAOYSA-N
XLogP130.90
TPSA261.58 Ų
H-Bond Donors
H-Bond Acceptors34
Rotatable Bonds64
Heavy Atoms476
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5006201.91
LogP ≤ 5130.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1034

Analyze 5-[2,7-ditert-butyl-9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-(2-methylphenyl)-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-naphthalen-1-yl-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]-N,N-diphenylfuran-2-amine;2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)-1,3-oxazol-2-yl]pyren-4-yl]-N,N-diphenyl-1,3-oxazol-5-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)thiophen-2-yl]pyren-4-yl]-N,N-diphenylthiophen-2-amine;N,N-diphenyl-5-[9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]furan-2-amine;N-(2-methylphenyl)-5-[9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine;N-naphthalen-1-yl-5-[9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine with MolForge

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Launch Full Analysis

Related Compounds

9-[6-(2,10-Diphenylanthracen-9-yl)-3-pyridinyl]carbazole;9-[5-(10-phenylanthracen-9-yl)furan-2-yl]carbazole;9-[5-(10-phenylanthracen-9-yl)thiophen-2-yl]carbazole
CID 157706063
9-(5-Anthracen-9-ylfuran-2-yl)carbazole;3-(4-anthracen-9-ylphenyl)-9-phenanthren-9-ylcarbazole;9-(6-anthracen-9-yl-3-pyridinyl)carbazole;9-(5-anthracen-9-ylthiophen-2-yl)carbazole
CID 157886477
Bis(2,5-bis(4-naphthalen-1-ylnaphthalen-1-yl)-1,3-oxazole);2-(4-tert-butylphenyl)-5-(4-naphthalen-1-ylnaphthalen-1-yl)-1,3-oxazole;5-(4-tert-butylphenyl)-2-(4-naphthalen-1-ylnaphthalen-1-yl)-1,3-oxazole;2-(4-tert-butylphenyl)-5-(4-naphthalen-1-ylnaphthalen-1-yl)-1,3-thiazole;2-(4-naphthalen-1-ylnaphthalen-1-yl)-5-(4-phenylphenyl)thiophene
CID 158250924
7-(3-Carbazol-9-ylphenyl)-2-(3-dibenzothiophen-4-ylphenyl)-[1]benzofuro[2,3-b]pyrazine;6-(3-dibenzofuran-4-ylphenyl)-2-(3-dibenzothiophen-4-ylphenyl)-[1]benzofuro[2,3-b]pyrazine
CID 158513706
2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)furo[3,2-b]furan-2-yl]pyren-4-yl]-N,N-diphenylfuro[3,2-b]furan-5-amine;2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)-1,3-oxazol-2-yl]pyren-4-yl]-N,N-diphenyl-1,3-oxazol-5-amine;2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)-1,3-thiazol-2-yl]pyren-4-yl]-N,N-diphenyl-1,3-thiazol-5-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)thiophen-2-yl]pyren-4-yl]-N,N-diphenylthiophen-2-amine
CID 158751149
7-(9,10-Ditert-butylanthracen-2-yl)-1,2-diphenyl-3-pyren-1-ylbenzo[e]indole;2-[4-(3-naphthalen-2-yl-1,2-diphenylbenzo[e]indol-7-yl)phenyl]-1,3-benzothiazole;2-[4-(3-naphthalen-1-yl-1,2-diphenylbenzo[e]indol-7-yl)phenyl]-1,3-benzoxazole;3-naphthalen-2-yl-1,2-diphenyl-7-(6-quinolin-3-yl-3-pyridinyl)benzo[e]indole
CID 159573966
6,17-Bis(5-butylfuran-2-yl)-6,17-diazapentacyclo[11.7.0.02,10.05,9.014,18]icosa-1(13),2(10),3,5(9),7,11,14(18),15,19-nonaene;6,17-bis(5-decylfuran-2-yl)-6,17-diazapentacyclo[11.7.0.02,10.05,9.014,18]icosa-1(13),2(10),3,5(9),7,11,14(18),15,19-nonaene;6,17-bis(4-decylthiophen-2-yl)-6,17-diazapentacyclo[11.7.0.02,10.05,9.014,18]icosa-1(13),2(10),3,5(9),7,11,14(18),15,19-nonaene;6,17-bis(5-hexylfuran-2-yl)-6,17-diazapentacyclo[11.7.0.02,10.05,9.014,18]icosa-1(13),2(10),3,5(9),7,11,14(18),15,19-nonaene;6,17-bis(3-hexylphenyl)-6,17-diazapentacyclo[11.7.0.02,10.05,9.014,18]icosa-1(13),2(10),3,5(9),7,11,14(18),15,19-nonaene;6,17-bis(4-hexylphenyl)-6,17-diazapentacyclo[11.7.0.02,10.05,9.014,18]icosa-1(13),2(10),3,5(9),7,11,14(18),15,19-nonaene;6,17-bis(4-hexylthiophen-2-yl)-6,17-diazapentacyclo[11.7.0.02,10.05,9.014,18]icosa-1(13),2(10),3,5(9),7,11,14(18),15,19-nonaene
CID 159588824
2,5-Bis(4-naphthalen-1-ylnaphthalen-1-yl)-1,3-oxazole;bis(2,5-bis(4-naphthalen-1-ylnaphthalen-1-yl)-1,3-thiazole);5-(4-tert-butylphenyl)-4-methyl-2-(4-naphthalen-1-ylnaphthalen-1-yl)-1,3-thiazole;5-(4-tert-butylphenyl)-2-(4-naphthalen-1-ylnaphthalen-1-yl)-1,3-oxazole;2-(4-tert-butylphenyl)-5-(4-naphthalen-1-ylnaphthalen-1-yl)-1,3-thiazole
CID 160327843
2,8-Bis[3-(3-dibenzothiophen-4-ylphenyl)phenyl]-[1]benzofuro[2,3-b]pyrazine;2-(3-dibenzothiophen-4-ylphenyl)-8-triphenylen-2-yl-[1]benzofuro[2,3-b]pyrazine
CID 160467634
13-[3-(3-Dibenzothiophen-4-ylphenyl)phenyl]-17-oxa-12,15-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11,13,15-octaene;13-[3-(4-dibenzothiophen-4-ylphenyl)phenyl]-17-oxa-12,15-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11,13,15-octaene;13-[3-[2-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-17-oxa-12,15-diazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11,13,15-octaene
CID 160637732
15-[3-(3-Dibenzothiophen-4-ylphenyl)phenyl]-8-phenyl-11-oxa-13,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12,14,16-octaene;15-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]-9-phenyl-11-oxa-13,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12,14,16-octaene;15-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]-11-oxa-13,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12,14,16-octaene
CID 160755784
15-[3-(3-Carbazol-9-ylphenyl)phenyl]-11-oxa-13,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12,14,16-octaene;15-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-11-oxa-13,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12,14,16-octaene;15-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]-11-oxa-13,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12,14,16-octaene
CID 161763578

Frequently Asked Questions

What is the IUPAC name of 5-[2,7-ditert-butyl-9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-(2-methylphenyl)-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-naphthalen-1-yl-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]-N,N-diphenylfuran-2-amine;2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)-1,3-oxazol-2-yl]pyren-4-yl]-N,N-diphenyl-1,3-oxazol-5-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)thiophen-2-yl]pyren-4-yl]-N,N-diphenylthiophen-2-amine;N,N-diphenyl-5-[9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]furan-2-amine;N-(2-methylphenyl)-5-[9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine;N-naphthalen-1-yl-5-[9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine?
The IUPAC name of 5-[2,7-ditert-butyl-9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-(2-methylphenyl)-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-naphthalen-1-yl-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]-N,N-diphenylfuran-2-amine;2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)-1,3-oxazol-2-yl]pyren-4-yl]-N,N-diphenyl-1,3-oxazol-5-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)thiophen-2-yl]pyren-4-yl]-N,N-diphenylthiophen-2-amine;N,N-diphenyl-5-[9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]furan-2-amine;N-(2-methylphenyl)-5-[9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine;N-naphthalen-1-yl-5-[9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine (CID 157202563) is 5-[2,7-ditert-butyl-9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-(2-methylphenyl)-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-naphthalen-1-yl-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]-N,N-diphenylfuran-2-amine;2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)-1,3-oxazol-2-yl]pyren-4-yl]-N,N-diphenyl-1,3-oxazol-5-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)thiophen-2-yl]pyren-4-yl]-N,N-diphenylthiophen-2-amine;N,N-diphenyl-5-[9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]furan-2-amine;N-(2-methylphenyl)-5-[9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine;N-naphthalen-1-yl-5-[9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine.
What is the SMILES notation for 5-[2,7-ditert-butyl-9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-(2-methylphenyl)-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-naphthalen-1-yl-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]-N,N-diphenylfuran-2-amine;2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)-1,3-oxazol-2-yl]pyren-4-yl]-N,N-diphenyl-1,3-oxazol-5-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)thiophen-2-yl]pyren-4-yl]-N,N-diphenylthiophen-2-amine;N,N-diphenyl-5-[9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]furan-2-amine;N-(2-methylphenyl)-5-[9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine;N-naphthalen-1-yl-5-[9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine?
The canonical SMILES for 5-[2,7-ditert-butyl-9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-(2-methylphenyl)-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-naphthalen-1-yl-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]-N,N-diphenylfuran-2-amine;2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)-1,3-oxazol-2-yl]pyren-4-yl]-N,N-diphenyl-1,3-oxazol-5-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)thiophen-2-yl]pyren-4-yl]-N,N-diphenylthiophen-2-amine;N,N-diphenyl-5-[9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]furan-2-amine;N-(2-methylphenyl)-5-[9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine;N-naphthalen-1-yl-5-[9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine is CC(C)(C)c1cc2cc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)o3)c3cc(C(C)(C)C)cc4cc(-c5ccc(N(c6ccccc6)c6cccc7ccccc67)o5)c(c1)c2c43.CC(C)(C)c1cc2cc(-c3ccc(N(c4ccccc4)c4ccccc4)o3)c3cc(C(C)(C)C)cc4cc(-c5ccc(N(c6ccccc6)c6ccccc6)o5)c(c1)c2c43.CC(C)(C)c1cc2cc(-c3ccc(N(c4ccccc4)c4ccccc4)s3)c3cc(C(C)(C)C)cc4cc(-c5ccc(N(c6ccccc6)c6ccccc6)s5)c(c1)c2c43.CC(C)(C)c1cc2cc(-c3ncc(N(c4ccccc4)c4ccccc4)o3)c3cc(C(C)(C)C)cc4cc(-c5ncc(N(c6ccccc6)c6ccccc6)o5)c(c1)c2c43.Cc1ccccc1N(c1ccccc1)c1ccc(-c2cc3cc(C(C)(C)C)cc4c(-c5ccc(N(c6ccccc6)c6ccccc6C)o5)cc5cc(C(C)(C)C)cc2c5c34)o1.Cc1ccccc1N(c1ccccc1)c1ccc(-c2cc3cccc4c(-c5ccc(N(c6ccccc6)c6ccccc6C)o5)cc5cccc2c5c34)o1.c1ccc(N(c2ccc(-c3cc4cccc5c(-c6ccc(N(c7ccccc7)c7cccc8ccccc78)o6)cc6cccc3c6c45)o2)c2cccc3ccccc23)cc1.c1ccc(N(c2ccccc2)c2ccc(-c3cc4cccc5c(-c6ccc(N(c7ccccc7)c7ccccc7)o6)cc6cccc3c6c45)o2)cc1.
What is the InChIKey of 5-[2,7-ditert-butyl-9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-(2-methylphenyl)-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-naphthalen-1-yl-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]-N,N-diphenylfuran-2-amine;2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)-1,3-oxazol-2-yl]pyren-4-yl]-N,N-diphenyl-1,3-oxazol-5-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)thiophen-2-yl]pyren-4-yl]-N,N-diphenylthiophen-2-amine;N,N-diphenyl-5-[9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]furan-2-amine;N-(2-methylphenyl)-5-[9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine;N-naphthalen-1-yl-5-[9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine?
The InChIKey is AQYVCIKUKAVMIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H52N2O2.C58H52N2O2.C56H36N2O2.C56H48N2O2.C56H48N2S2.C54H46N4O2.C50H36N2O2.C48H32N2O2/c1-63(2,3)45-35-43-37-52(58-32-34-60(68-58)66(48-25-11-8-12-26-48)56-30-18-22-42-20-14-16-28-50(42)56)54-40-46(64(4,5)6)36-44-38-51(53(39-45)61(43)62(44)54)57-31-33-59(67-57)65(47-23-9-7-10-24-47)55-29-17-21-41-19-13-15-27-49(41)55;1-37-19-15-17-25-49(37)59(43-21-11-9-12-22-43)53-29-27-51(61-53)45-33-39-31-42(58(6,7)8)36-48-46(34-40-32-41(57(3,4)5)35-47(45)55(40)56(39)48)52-28-30-54(62-52)60(44-23-13-10-14-24-44)50-26-18-16-20-38(50)2;1-3-21-41(22-4-1)57(49-29-13-17-37-15-7-9-25-43(37)49)53-33-31-51(59-53)47-35-39-19-12-28-46-48(36-40-20-11-27-45(47)55(40)56(39)46)52-32-34-54(60-52)58(42-23-5-2-6-24-42)50-30-14-18-38-16-8-10-26-44(38)50;2*1-55(2,3)39-31-37-33-46(50-28-30-52(60-50)58(43-23-15-9-16-24-43)44-25-17-10-18-26-44)48-36-40(56(4,5)6)32-38-34-45(47(35-39)53(37)54(38)48)49-27-29-51(59-49)57(41-19-11-7-12-20-41)42-21-13-8-14-22-42;1-53(2,3)37-27-35-29-46(52-56-34-48(60-52)58(41-23-15-9-16-24-41)42-25-17-10-18-26-42)44-32-38(54(4,5)6)28-36-30-45(43(31-37)49(35)50(36)44)51-55-33-47(59-51)57(39-19-11-7-12-20-39)40-21-13-8-14-22-40;1-33-15-9-11-25-43(33)51(37-19-5-3-6-20-37)47-29-27-45(53-47)41-31-35-17-14-24-40-42(32-36-18-13-23-39(41)49(36)50(35)40)46-28-30-48(54-46)52(38-21-7-4-8-22-38)44-26-12-10-16-34(44)2;1-5-17-35(18-6-1)49(36-19-7-2-8-20-36)45-29-27-43(51-45)41-31-33-15-14-26-40-42(32-34-16-13-25-39(41)47(34)48(33)40)44-28-30-46(52-44)50(37-21-9-3-10-22-37)38-23-11-4-12-24-38/h7-40H,1-6H3;9-36H,1-8H3;1-36H;2*7-36H,1-6H3;7-34H,1-6H3;3-32H,1-2H3;1-32H.
What are the key properties of 5-[2,7-ditert-butyl-9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-(2-methylphenyl)-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-naphthalen-1-yl-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]-N,N-diphenylfuran-2-amine;2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)-1,3-oxazol-2-yl]pyren-4-yl]-N,N-diphenyl-1,3-oxazol-5-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)thiophen-2-yl]pyren-4-yl]-N,N-diphenylthiophen-2-amine;N,N-diphenyl-5-[9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]furan-2-amine;N-(2-methylphenyl)-5-[9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine;N-naphthalen-1-yl-5-[9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine?
5-[2,7-ditert-butyl-9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-(2-methylphenyl)-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-naphthalen-1-yl-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]-N,N-diphenylfuran-2-amine;2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)-1,3-oxazol-2-yl]pyren-4-yl]-N,N-diphenyl-1,3-oxazol-5-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)thiophen-2-yl]pyren-4-yl]-N,N-diphenylthiophen-2-amine;N,N-diphenyl-5-[9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]furan-2-amine;N-(2-methylphenyl)-5-[9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine;N-naphthalen-1-yl-5-[9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine has a molecular weight of 6201.91 g/mol, XLogP of 130.90, 64 rotatable bonds, 0 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2,7-ditert-butyl-9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-(2-methylphenyl)-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-naphthalen-1-yl-N-phenylfuran-2-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]-N,N-diphenylfuran-2-amine;2-[2,7-ditert-butyl-9-[5-(N-phenylanilino)-1,3-oxazol-2-yl]pyren-4-yl]-N,N-diphenyl-1,3-oxazol-5-amine;5-[2,7-ditert-butyl-9-[5-(N-phenylanilino)thiophen-2-yl]pyren-4-yl]-N,N-diphenylthiophen-2-amine;N,N-diphenyl-5-[9-[5-(N-phenylanilino)furan-2-yl]pyren-4-yl]furan-2-amine;N-(2-methylphenyl)-5-[9-[5-(N-(2-methylphenyl)anilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine;N-naphthalen-1-yl-5-[9-[5-(N-naphthalen-1-ylanilino)furan-2-yl]pyren-4-yl]-N-phenylfuran-2-amine is sourced from PubChem (CID 157202563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).