About 12-(4-carbazol-9-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(4-dibenzofuran-1-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzothiophen-3-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9,9-dimethylfluoren-2-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;11-(3,5-diphenylphenyl)-8-methyl-[1]benzothiolo[3,2-b]carbazole;12-naphthalen-1-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9-phenylcarbazol-3-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene
12-(4-carbazol-9-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(4-dibenzofuran-1-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzothiophen-3-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9,9-dimethylfluoren-2-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;11-(3,5-diphenylphenyl)-8-methyl-[1]benzothiolo[3,2-b]carbazole;12-naphthalen-1-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9-phenylcarbazol-3-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene (PubChem CID 158824236) has the molecular formula C294H178N10O2S9
and a molecular weight of 4171.33 g/mol. Its IUPAC name is 12-(4-carbazol-9-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(4-dibenzofuran-1-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzothiophen-3-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9,9-dimethylfluoren-2-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;11-(3,5-diphenylphenyl)-8-methyl-[1]benzothiolo[3,2-b]carbazole;12-naphthalen-1-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9-phenylcarbazol-3-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene.
Frequently Asked Questions
What is the IUPAC name of 12-(4-carbazol-9-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(4-dibenzofuran-1-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzothiophen-3-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9,9-dimethylfluoren-2-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;11-(3,5-diphenylphenyl)-8-methyl-[1]benzothiolo[3,2-b]carbazole;12-naphthalen-1-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9-phenylcarbazol-3-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene?
The IUPAC name of 12-(4-carbazol-9-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(4-dibenzofuran-1-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzothiophen-3-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9,9-dimethylfluoren-2-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;11-(3,5-diphenylphenyl)-8-methyl-[1]benzothiolo[3,2-b]carbazole;12-naphthalen-1-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9-phenylcarbazol-3-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene (CID 158824236) is 12-(4-carbazol-9-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(4-dibenzofuran-1-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzothiophen-3-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9,9-dimethylfluoren-2-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;11-(3,5-diphenylphenyl)-8-methyl-[1]benzothiolo[3,2-b]carbazole;12-naphthalen-1-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9-phenylcarbazol-3-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene.
What is the SMILES notation for 12-(4-carbazol-9-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(4-dibenzofuran-1-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzothiophen-3-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9,9-dimethylfluoren-2-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;11-(3,5-diphenylphenyl)-8-methyl-[1]benzothiolo[3,2-b]carbazole;12-naphthalen-1-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9-phenylcarbazol-3-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene?
The canonical SMILES for 12-(4-carbazol-9-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(4-dibenzofuran-1-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzothiophen-3-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9,9-dimethylfluoren-2-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;11-(3,5-diphenylphenyl)-8-methyl-[1]benzothiolo[3,2-b]carbazole;12-naphthalen-1-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9-phenylcarbazol-3-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene is CC1(C)c2ccccc2-c2ccc(-n3c4cc5ccccc5cc4c4cc5sc6ccccc6c5cc43)cc21.Cc1ccc2c(c1)c1cc3sc4ccccc4c3cc1n2-c1cc(-c2ccccc2)cc(-c2ccccc2)c1.c1ccc(-n2c3ccccc3c3cc(-n4c5cc6ccccc6cc5c5cc6sc7ccccc7c6cc54)ccc32)cc1.c1ccc2cc3c(cc2c1)c1cc2sc4ccccc4c2cc1n3-c1ccc(-c2cccc3oc4ccccc4c23)cc1.c1ccc2cc3c(cc2c1)c1cc2sc4ccccc4c2cc1n3-c1ccc(-n2c3ccccc3c3ccccc32)cc1.c1ccc2cc3c(cc2c1)c1cc2sc4ccccc4c2cc1n3-c1ccc2c(c1)sc1ccccc12.c1ccc2cc3c(cc2c1)c1cc2sc4ccccc4c2cc1n3-c1ccc2oc3ccccc3c2c1.c1ccc2cc3c(cc2c1)c1cc2sc4ccccc4c2cc1n3-c1cccc2ccccc12.
What is the InChIKey of 12-(4-carbazol-9-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(4-dibenzofuran-1-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzothiophen-3-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9,9-dimethylfluoren-2-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;11-(3,5-diphenylphenyl)-8-methyl-[1]benzothiolo[3,2-b]carbazole;12-naphthalen-1-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9-phenylcarbazol-3-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene?
The InChIKey is IWGGIXUBNYRYOG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C40H24N2S.C40H23NOS.2C37H25NS.C34H19NOS.C34H19NS2.C32H19NS/c1-2-10-26-22-37-32(21-25(26)9-1)33-24-40-34(31-13-5-8-16-39(31)43-40)23-38(33)42(37)28-19-17-27(18-20-28)41-35-14-6-3-11-29(35)30-12-4-7-15-36(30)41;1-2-12-27(13-3-1)41-35-16-8-6-14-29(35)32-22-28(18-19-36(32)41)42-37-21-26-11-5-4-10-25(26)20-31(37)33-24-40-34(23-38(33)42)30-15-7-9-17-39(30)43-40;1-2-9-26-21-34-31(20-25(26)8-1)32-23-39-33(29-10-4-6-15-38(29)43-39)22-35(32)41(34)27-18-16-24(17-19-27)28-12-7-14-37-40(28)30-11-3-5-13-36(30)42-37;1-37(2)31-13-7-5-11-25(31)26-16-15-24(19-32(26)37)38-33-18-23-10-4-3-9-22(23)17-28(33)29-21-36-30(20-34(29)38)27-12-6-8-14-35(27)39-36;1-24-16-17-34-31(18-24)32-23-37-33(30-14-8-9-15-36(30)39-37)22-35(32)38(34)29-20-27(25-10-4-2-5-11-25)19-28(21-29)26-12-6-3-7-13-26;1-2-8-21-16-29-25(15-20(21)7-1)26-19-34-28(24-10-4-6-12-33(24)37-34)18-30(26)35(29)22-13-14-32-27(17-22)23-9-3-5-11-31(23)36-32;1-2-8-21-16-29-26(15-20(21)7-1)27-19-34-28(24-10-4-6-12-32(24)37-34)18-30(27)35(29)22-13-14-25-23-9-3-5-11-31(23)36-33(25)17-22;1-2-10-22-17-29-25(16-21(22)9-1)26-19-32-27(24-13-5-6-15-31(24)34-32)18-30(26)33(29)28-14-7-11-20-8-3-4-12-23(20)28/h2*1-24H;1-23H;3-21H,1-2H3;2-23H,1H3;2*1-19H;1-19H.
What are the key properties of 12-(4-carbazol-9-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(4-dibenzofuran-1-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzothiophen-3-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9,9-dimethylfluoren-2-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;11-(3,5-diphenylphenyl)-8-methyl-[1]benzothiolo[3,2-b]carbazole;12-naphthalen-1-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9-phenylcarbazol-3-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene?
12-(4-carbazol-9-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(4-dibenzofuran-1-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzothiophen-3-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9,9-dimethylfluoren-2-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;11-(3,5-diphenylphenyl)-8-methyl-[1]benzothiolo[3,2-b]carbazole;12-naphthalen-1-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9-phenylcarbazol-3-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene has a molecular weight of 4171.33 g/mol, XLogP of 86.42, 13 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 12-(4-carbazol-9-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(4-dibenzofuran-1-ylphenyl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-dibenzothiophen-3-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9,9-dimethylfluoren-2-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;11-(3,5-diphenylphenyl)-8-methyl-[1]benzothiolo[3,2-b]carbazole;12-naphthalen-1-yl-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;12-(9-phenylcarbazol-3-yl)-22-thia-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene is sourced from PubChem (CID 158824236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).