About 14-[6-[9,9-bis(4-methylphenyl)acridin-10-yl]-9,10-bis(8-phenyldibenzofuran-2-yl)anthracen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[6-[10,10-bis(4-methylphenyl)benzo[b][1,4]benzazasilin-5-yl]-4,8-bis(5-methylthiophen-2-yl)naphthalen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-aza-21-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;21,21-dibutyl-14-[6-(9,9-dibutylacridin-10-yl)-3,8-di(propan-2-yl)pyren-1-yl]-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[5-(9,9-dipyridin-4-ylacridin-10-yl)-3,7-dimethylnaphthalen-1-yl]-10,10-dimethyl-21,21-dipyridin-4-yl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;methane
14-[6-[9,9-bis(4-methylphenyl)acridin-10-yl]-9,10-bis(8-phenyldibenzofuran-2-yl)anthracen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[6-[10,10-bis(4-methylphenyl)benzo[b][1,4]benzazasilin-5-yl]-4,8-bis(5-methylthiophen-2-yl)naphthalen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-aza-21-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;21,21-dibutyl-14-[6-(9,9-dibutylacridin-10-yl)-3,8-di(propan-2-yl)pyren-1-yl]-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[5-(9,9-dipyridin-4-ylacridin-10-yl)-3,7-dimethylnaphthalen-1-yl]-10,10-dimethyl-21,21-dipyridin-4-yl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;methane (PubChem CID 157172308) has the molecular formula C327H266N12O2S2Se3Si2
and a molecular weight of 4752.99 g/mol. Its IUPAC name is 14-[6-[9,9-bis(4-methylphenyl)acridin-10-yl]-9,10-bis(8-phenyldibenzofuran-2-yl)anthracen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[6-[10,10-bis(4-methylphenyl)benzo[b][1,4]benzazasilin-5-yl]-4,8-bis(5-methylthiophen-2-yl)naphthalen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-aza-21-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;21,21-dibutyl-14-[6-(9,9-dibutylacridin-10-yl)-3,8-di(propan-2-yl)pyren-1-yl]-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[5-(9,9-dipyridin-4-ylacridin-10-yl)-3,7-dimethylnaphthalen-1-yl]-10,10-dimethyl-21,21-dipyridin-4-yl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;methane.
Frequently Asked Questions
What is the IUPAC name of 14-[6-[9,9-bis(4-methylphenyl)acridin-10-yl]-9,10-bis(8-phenyldibenzofuran-2-yl)anthracen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[6-[10,10-bis(4-methylphenyl)benzo[b][1,4]benzazasilin-5-yl]-4,8-bis(5-methylthiophen-2-yl)naphthalen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-aza-21-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;21,21-dibutyl-14-[6-(9,9-dibutylacridin-10-yl)-3,8-di(propan-2-yl)pyren-1-yl]-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[5-(9,9-dipyridin-4-ylacridin-10-yl)-3,7-dimethylnaphthalen-1-yl]-10,10-dimethyl-21,21-dipyridin-4-yl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;methane?
The IUPAC name of 14-[6-[9,9-bis(4-methylphenyl)acridin-10-yl]-9,10-bis(8-phenyldibenzofuran-2-yl)anthracen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[6-[10,10-bis(4-methylphenyl)benzo[b][1,4]benzazasilin-5-yl]-4,8-bis(5-methylthiophen-2-yl)naphthalen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-aza-21-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;21,21-dibutyl-14-[6-(9,9-dibutylacridin-10-yl)-3,8-di(propan-2-yl)pyren-1-yl]-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[5-(9,9-dipyridin-4-ylacridin-10-yl)-3,7-dimethylnaphthalen-1-yl]-10,10-dimethyl-21,21-dipyridin-4-yl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;methane (CID 157172308) is 14-[6-[9,9-bis(4-methylphenyl)acridin-10-yl]-9,10-bis(8-phenyldibenzofuran-2-yl)anthracen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[6-[10,10-bis(4-methylphenyl)benzo[b][1,4]benzazasilin-5-yl]-4,8-bis(5-methylthiophen-2-yl)naphthalen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-aza-21-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;21,21-dibutyl-14-[6-(9,9-dibutylacridin-10-yl)-3,8-di(propan-2-yl)pyren-1-yl]-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[5-(9,9-dipyridin-4-ylacridin-10-yl)-3,7-dimethylnaphthalen-1-yl]-10,10-dimethyl-21,21-dipyridin-4-yl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;methane.
What is the SMILES notation for 14-[6-[9,9-bis(4-methylphenyl)acridin-10-yl]-9,10-bis(8-phenyldibenzofuran-2-yl)anthracen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[6-[10,10-bis(4-methylphenyl)benzo[b][1,4]benzazasilin-5-yl]-4,8-bis(5-methylthiophen-2-yl)naphthalen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-aza-21-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;21,21-dibutyl-14-[6-(9,9-dibutylacridin-10-yl)-3,8-di(propan-2-yl)pyren-1-yl]-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[5-(9,9-dipyridin-4-ylacridin-10-yl)-3,7-dimethylnaphthalen-1-yl]-10,10-dimethyl-21,21-dipyridin-4-yl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;methane?
The canonical SMILES for 14-[6-[9,9-bis(4-methylphenyl)acridin-10-yl]-9,10-bis(8-phenyldibenzofuran-2-yl)anthracen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[6-[10,10-bis(4-methylphenyl)benzo[b][1,4]benzazasilin-5-yl]-4,8-bis(5-methylthiophen-2-yl)naphthalen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-aza-21-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;21,21-dibutyl-14-[6-(9,9-dibutylacridin-10-yl)-3,8-di(propan-2-yl)pyren-1-yl]-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[5-(9,9-dipyridin-4-ylacridin-10-yl)-3,7-dimethylnaphthalen-1-yl]-10,10-dimethyl-21,21-dipyridin-4-yl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;methane is C.C.CCCCC1(CCCC)c2ccccc2N(c2cc(C(C)C)c3ccc4c(N5c6ccccc6C(CCCC)(CCCC)c6cc7c(cc65)[se]c5ccccc57)cc(C(C)C)c5ccc2c3c54)c2ccccc21.Cc1cc(N2c3ccccc3C(c3ccncc3)(c3ccncc3)c3cc4c(cc32)C(C)(C)c2ccccc2-4)c2cc(C)cc(N3c4ccccc4C(c4ccncc4)(c4ccncc4)c4ccccc43)c2c1.Cc1ccc(C2(c3ccc(C)cc3)c3ccccc3N(c3ccc4c(-c5ccc6oc7ccc(-c8ccccc8)cc7c6c5)c5cc(N6c7ccccc7C(c7ccc(C)cc7)(c7ccc(C)cc7)c7cc8c(cc76)[se]c6ccccc68)ccc5c(-c5ccc6oc7ccc(-c8ccccc8)cc7c6c5)c4c3)c3ccccc32)cc1.Cc1ccc([Si]2(c3ccc(C)cc3)c3ccccc3N(c3cc(-c4ccc(C)s4)c4cc(N5c6ccccc6[Si](c6ccc(C)cc6)(c6ccc(C)cc6)c6cc7c(cc65)[se]c5ccccc57)cc(-c5ccc(C)s5)c4c3)c3ccccc32)cc1.
What is the InChIKey of 14-[6-[9,9-bis(4-methylphenyl)acridin-10-yl]-9,10-bis(8-phenyldibenzofuran-2-yl)anthracen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[6-[10,10-bis(4-methylphenyl)benzo[b][1,4]benzazasilin-5-yl]-4,8-bis(5-methylthiophen-2-yl)naphthalen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-aza-21-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;21,21-dibutyl-14-[6-(9,9-dibutylacridin-10-yl)-3,8-di(propan-2-yl)pyren-1-yl]-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[5-(9,9-dipyridin-4-ylacridin-10-yl)-3,7-dimethylnaphthalen-1-yl]-10,10-dimethyl-21,21-dipyridin-4-yl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;methane?
The InChIKey is ANPONFUZTSVYJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C110H74N2O2Se.C78H60N2S2SeSi2.C70H74N2Se.C67H50N6.2CH4/c1-67-31-43-77(44-32-67)109(78-45-33-68(2)34-46-78)93-24-12-15-27-97(93)111(98-28-16-13-25-94(98)109)81-51-53-84-91(63-81)107(75-41-57-103-88(61-75)86-59-73(39-55-101(86)113-103)71-19-7-5-8-20-71)85-54-52-82(64-92(85)108(84)76-42-58-104-89(62-76)87-60-74(40-56-102(87)114-104)72-21-9-6-10-22-72)112-99-29-17-14-26-95(99)110(79-47-35-69(3)36-48-79,80-49-37-70(4)38-50-80)96-65-90-83-23-11-18-30-105(83)115-106(90)66-100(96)112;1-49-23-33-57(34-24-49)84(58-35-25-50(2)26-36-58)75-20-12-8-16-67(75)79(68-17-9-13-21-76(68)84)55-43-62-63(64(45-55)71-41-31-53(5)81-71)44-56(46-65(62)72-42-32-54(6)82-72)80-69-18-10-14-22-77(69)85(59-37-27-51(3)28-38-59,60-39-29-52(4)30-40-60)78-47-66-61-15-7-11-19-73(61)83-74(66)48-70(78)80;1-9-13-37-69(38-14-10-2)55-26-18-21-29-59(55)71(60-30-22-19-27-56(60)69)62-42-52(45(5)6)48-34-36-51-63(43-53(46(7)8)49-33-35-50(62)67(48)68(49)51)72-61-31-23-20-28-57(61)70(39-15-11-3,40-16-12-4)58-41-54-47-25-17-24-32-65(47)73-66(54)44-64(58)72;1-43-38-52-51(62(39-43)72-59-18-10-7-15-54(59)66(45-21-29-68-30-22-45,46-23-31-69-32-24-46)55-16-8-11-19-60(55)72)37-44(2)40-63(52)73-61-20-12-9-17-56(61)67(47-25-33-70-34-26-47,48-27-35-71-36-28-48)58-41-50-49-13-5-6-14-53(49)65(3,4)57(50)42-64(58)73;;/h5-66H,1-4H3;7-48H,1-6H3;17-36,41-46H,9-16,37-40H2,1-8H3;5-42H,1-4H3;2*1H4.
What are the key properties of 14-[6-[9,9-bis(4-methylphenyl)acridin-10-yl]-9,10-bis(8-phenyldibenzofuran-2-yl)anthracen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[6-[10,10-bis(4-methylphenyl)benzo[b][1,4]benzazasilin-5-yl]-4,8-bis(5-methylthiophen-2-yl)naphthalen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-aza-21-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;21,21-dibutyl-14-[6-(9,9-dibutylacridin-10-yl)-3,8-di(propan-2-yl)pyren-1-yl]-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[5-(9,9-dipyridin-4-ylacridin-10-yl)-3,7-dimethylnaphthalen-1-yl]-10,10-dimethyl-21,21-dipyridin-4-yl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;methane?
14-[6-[9,9-bis(4-methylphenyl)acridin-10-yl]-9,10-bis(8-phenyldibenzofuran-2-yl)anthracen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[6-[10,10-bis(4-methylphenyl)benzo[b][1,4]benzazasilin-5-yl]-4,8-bis(5-methylthiophen-2-yl)naphthalen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-aza-21-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;21,21-dibutyl-14-[6-(9,9-dibutylacridin-10-yl)-3,8-di(propan-2-yl)pyren-1-yl]-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[5-(9,9-dipyridin-4-ylacridin-10-yl)-3,7-dimethylnaphthalen-1-yl]-10,10-dimethyl-21,21-dipyridin-4-yl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;methane has a molecular weight of 4752.99 g/mol, XLogP of 83.26, 40 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 14-[6-[9,9-bis(4-methylphenyl)acridin-10-yl]-9,10-bis(8-phenyldibenzofuran-2-yl)anthracen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[6-[10,10-bis(4-methylphenyl)benzo[b][1,4]benzazasilin-5-yl]-4,8-bis(5-methylthiophen-2-yl)naphthalen-2-yl]-21,21-bis(4-methylphenyl)-10-selena-14-aza-21-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;21,21-dibutyl-14-[6-(9,9-dibutylacridin-10-yl)-3,8-di(propan-2-yl)pyren-1-yl]-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[5-(9,9-dipyridin-4-ylacridin-10-yl)-3,7-dimethylnaphthalen-1-yl]-10,10-dimethyl-21,21-dipyridin-4-yl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;methane is sourced from PubChem (CID 157172308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).