6-[3-(5-dibenzofuran-2-ylthiophen-2-yl)carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;8-[3-(1-dibenzothiophen-2-ylcyclohexyl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-(8-dibenzothiophen-2-yldibenzofuran-2-yl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;6-[3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;6-[3-[[9-(2-methylphenyl)carbazol-3-yl]methyl]carbazol-9-yl]-[1]benzothiolo[2,3-c]pyridine;8-[3-[8-(5-methylpyrido[3,2-b]indol-8-yl)dibenzofuran-2-yl]carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]-[1]benzothiolo[3,2-c]pyridine

C317H196N18O3S11 — CID 157449968

IUPAC6-[3-(5-dibenzofuran-2-ylthiophen-2-yl)carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;8-[3-(1-dibenzothiophen-2-ylcyclohexyl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-(8-dibenzothiophen-2-yldibenzofuran-2-yl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;6-[3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;6-[3-[[9-(2-methylphenyl)carbazol-3-yl]methyl]carbazol-9-yl]-[1]benzothiolo[2,3-c]pyridine;8-[3-[8-(5-methylpyrido[3,2-b]indol-8-yl)dibenzofuran-2-yl]carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]-[1]benzothiolo[3,2-c]pyridine
SMILESCc1ccccc1-n1c2ccccc2c2cc(Cc3ccc4c(c3)c3ccccc3n4-c3ccc4sc5cnccc5c4c3)ccc21.Cn1c2ccc(-c3ccc4oc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccc7sc8cccnc8c7c6)cc5c4c3)cc2c2ncccc21.c1cc(-c2cccc(-c3cccc4c3sc3ccccc34)c2)cc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3sc4ncccc4c3c2)c1.c1ccc(-c2cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc(-c3ccc4c(c3)c3ccccc3n4-c3ccc4sc5ccncc5c4c3)c2)cc1.c1ccc2c(c1)oc1ccc(-c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5sc6ncccc6c5c4)s3)cc12.c1ccc2c(c1)sc1ccc(-c3ccc4oc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccc7sc8cccnc8c7c6)cc5c4c3)cc12.c1ccc2c(c1)sc1ccc(C3(c4ccc5c(c4)c4ccccc4n5-c4ccc5sc6cccnc6c5c4)CCCCC3)cc12
InChIInChI=1S/C53H33N3S.C47H28N4OS.C47H26N2OS2.C47H28N2S2.C43H29N3S.C41H30N2S2.C39H22N2OS2/c1-3-11-34(12-4-1)37-27-38(35-19-22-50-44(30-35)42-15-7-9-17-48(42)55(50)40-13-5-2-6-14-40)29-39(28-37)36-20-23-51-45(31-36)43-16-8-10-18-49(43)56(51)41-21-24-52-46(32-41)47-33-54-26-25-53(47)57-52;1-50-38-15-10-28(25-36(38)46-41(50)8-4-20-48-46)30-13-18-43-35(24-30)34-23-29(12-17-42(34)52-43)27-11-16-40-33(22-27)32-6-2-3-7-39(32)51(40)31-14-19-44-37(26-31)47-45(53-44)9-5-21-49-47;1-3-8-39-32(6-1)34-22-27(11-16-40(34)49(39)31-15-20-45-38(26-31)47-46(52-45)10-5-21-48-47)28-12-17-41-35(23-28)36-24-29(13-18-42(36)50-41)30-14-19-44-37(25-30)33-7-2-4-9-43(33)51-44;1-3-18-42-36(13-1)40-27-32(20-22-43(40)49(42)34-21-23-45-41(28-34)39-17-8-24-48-47(39)51-45)30-10-5-9-29(25-30)31-11-6-12-33(26-31)35-15-7-16-38-37-14-2-4-19-44(37)50-46(35)38;1-27-8-2-5-11-37(27)46-39-13-7-4-10-32(39)35-24-29(15-18-41(35)46)22-28-14-17-40-34(23-28)31-9-3-6-12-38(31)45(40)30-16-19-42-36(25-30)33-20-21-44-26-43(33)47-42;1-6-20-41(21-7-1,27-15-18-37-32(24-27)30-10-3-5-12-36(30)44-37)26-14-17-35-31(23-26)29-9-2-4-11-34(29)43(35)28-16-19-38-33(25-28)40-39(45-38)13-8-22-42-40;1-3-9-32-26(6-1)29-20-23(11-14-33(29)41(32)25-13-16-38-31(22-25)28-8-5-19-40-39(28)44-38)36-17-18-37(43-36)24-12-15-35-30(21-24)27-7-2-4-10-34(27)42-35/h1-33H;2-26H,1H3;1-26H;1-28H;2-21,23-26H,22H2,1H3;2-5,8-19,22-25H,1,6-7,20-21H2;1-22H
InChIKeyBSRKDXNHPVYQIC-UHFFFAOYSA-N
MW4657.91 g/mol
LogP91.08
Rot. Bonds25

About 6-[3-(5-dibenzofuran-2-ylthiophen-2-yl)carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;8-[3-(1-dibenzothiophen-2-ylcyclohexyl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-(8-dibenzothiophen-2-yldibenzofuran-2-yl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;6-[3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;6-[3-[[9-(2-methylphenyl)carbazol-3-yl]methyl]carbazol-9-yl]-[1]benzothiolo[2,3-c]pyridine;8-[3-[8-(5-methylpyrido[3,2-b]indol-8-yl)dibenzofuran-2-yl]carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]-[1]benzothiolo[3,2-c]pyridine

6-[3-(5-dibenzofuran-2-ylthiophen-2-yl)carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;8-[3-(1-dibenzothiophen-2-ylcyclohexyl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-(8-dibenzothiophen-2-yldibenzofuran-2-yl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;6-[3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;6-[3-[[9-(2-methylphenyl)carbazol-3-yl]methyl]carbazol-9-yl]-[1]benzothiolo[2,3-c]pyridine;8-[3-[8-(5-methylpyrido[3,2-b]indol-8-yl)dibenzofuran-2-yl]carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]-[1]benzothiolo[3,2-c]pyridine (PubChem CID 157449968) has the molecular formula C317H196N18O3S11 and a molecular weight of 4657.91 g/mol. Its IUPAC name is 6-[3-(5-dibenzofuran-2-ylthiophen-2-yl)carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;8-[3-(1-dibenzothiophen-2-ylcyclohexyl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-(8-dibenzothiophen-2-yldibenzofuran-2-yl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;6-[3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;6-[3-[[9-(2-methylphenyl)carbazol-3-yl]methyl]carbazol-9-yl]-[1]benzothiolo[2,3-c]pyridine;8-[3-[8-(5-methylpyrido[3,2-b]indol-8-yl)dibenzofuran-2-yl]carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]-[1]benzothiolo[3,2-c]pyridine.

Molecular Properties

Compound Name6-[3-(5-dibenzofuran-2-ylthiophen-2-yl)carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;8-[3-(1-dibenzothiophen-2-ylcyclohexyl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-(8-dibenzothiophen-2-yldibenzofuran-2-yl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;6-[3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;6-[3-[[9-(2-methylphenyl)carbazol-3-yl]methyl]carbazol-9-yl]-[1]benzothiolo[2,3-c]pyridine;8-[3-[8-(5-methylpyrido[3,2-b]indol-8-yl)dibenzofuran-2-yl]carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]-[1]benzothiolo[3,2-c]pyridine
PubChem CID157449968
Molecular FormulaC317H196N18O3S11
Molecular Weight4657.91 g/mol
Exact Mass4653.27
IUPAC Name6-[3-(5-dibenzofuran-2-ylthiophen-2-yl)carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;8-[3-(1-dibenzothiophen-2-ylcyclohexyl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-(8-dibenzothiophen-2-yldibenzofuran-2-yl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;6-[3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;6-[3-[[9-(2-methylphenyl)carbazol-3-yl]methyl]carbazol-9-yl]-[1]benzothiolo[2,3-c]pyridine;8-[3-[8-(5-methylpyrido[3,2-b]indol-8-yl)dibenzofuran-2-yl]carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]-[1]benzothiolo[3,2-c]pyridine
SMILESCc1ccccc1-n1c2ccccc2c2cc(Cc3ccc4c(c3)c3ccccc3n4-c3ccc4sc5cnccc5c4c3)ccc21.Cn1c2ccc(-c3ccc4oc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccc7sc8cccnc8c7c6)cc5c4c3)cc2c2ncccc21.c1cc(-c2cccc(-c3cccc4c3sc3ccccc34)c2)cc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3sc4ncccc4c3c2)c1.c1ccc(-c2cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc(-c3ccc4c(c3)c3ccccc3n4-c3ccc4sc5ccncc5c4c3)c2)cc1.c1ccc2c(c1)oc1ccc(-c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5sc6ncccc6c5c4)s3)cc12.c1ccc2c(c1)sc1ccc(-c3ccc4oc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccc7sc8cccnc8c7c6)cc5c4c3)cc12.c1ccc2c(c1)sc1ccc(C3(c4ccc5c(c4)c4ccccc4n5-c4ccc5sc6cccnc6c5c4)CCCCC3)cc12
InChIInChI=1S/C53H33N3S.C47H28N4OS.C47H26N2OS2.C47H28N2S2.C43H29N3S.C41H30N2S2.C39H22N2OS2/c1-3-11-34(12-4-1)37-27-38(35-19-22-50-44(30-35)42-15-7-9-17-48(42)55(50)40-13-5-2-6-14-40)29-39(28-37)36-20-23-51-45(31-36)43-16-8-10-18-49(43)56(51)41-21-24-52-46(32-41)47-33-54-26-25-53(47)57-52;1-50-38-15-10-28(25-36(38)46-41(50)8-4-20-48-46)30-13-18-43-35(24-30)34-23-29(12-17-42(34)52-43)27-11-16-40-33(22-27)32-6-2-3-7-39(32)51(40)31-14-19-44-37(26-31)47-45(53-44)9-5-21-49-47;1-3-8-39-32(6-1)34-22-27(11-16-40(34)49(39)31-15-20-45-38(26-31)47-46(52-45)10-5-21-48-47)28-12-17-41-35(23-28)36-24-29(13-18-42(36)50-41)30-14-19-44-37(25-30)33-7-2-4-9-43(33)51-44;1-3-18-42-36(13-1)40-27-32(20-22-43(40)49(42)34-21-23-45-41(28-34)39-17-8-24-48-47(39)51-45)30-10-5-9-29(25-30)31-11-6-12-33(26-31)35-15-7-16-38-37-14-2-4-19-44(37)50-46(35)38;1-27-8-2-5-11-37(27)46-39-13-7-4-10-32(39)35-24-29(15-18-41(35)46)22-28-14-17-40-34(23-28)31-9-3-6-12-38(31)45(40)30-16-19-42-36(25-30)33-20-21-44-26-43(33)47-42;1-6-20-41(21-7-1,27-15-18-37-32(24-27)30-10-3-5-12-36(30)44-37)26-14-17-35-31(23-26)29-9-2-4-11-34(29)43(35)28-16-19-38-33(25-28)40-39(45-38)13-8-22-42-40;1-3-9-32-26(6-1)29-20-23(11-14-33(29)41(32)25-13-16-38-31(22-25)28-8-5-19-40-39(28)44-38)36-17-18-37(43-36)24-12-15-35-30(21-24)27-7-2-4-10-34(27)42-35/h1-33H;2-26H,1H3;1-26H;1-28H;2-21,23-26H,22H2,1H3;2-5,8-19,22-25H,1,6-7,20-21H2;1-22H
InChIKeyBSRKDXNHPVYQIC-UHFFFAOYSA-N
XLogP91.08
TPSA191.84 Ų
H-Bond Donors
H-Bond Acceptors32
Rotatable Bonds25
Heavy Atoms349
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004657.91
LogP ≤ 591.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1032

Analyze 6-[3-(5-dibenzofuran-2-ylthiophen-2-yl)carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;8-[3-(1-dibenzothiophen-2-ylcyclohexyl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-(8-dibenzothiophen-2-yldibenzofuran-2-yl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;6-[3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;6-[3-[[9-(2-methylphenyl)carbazol-3-yl]methyl]carbazol-9-yl]-[1]benzothiolo[2,3-c]pyridine;8-[3-[8-(5-methylpyrido[3,2-b]indol-8-yl)dibenzofuran-2-yl]carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]-[1]benzothiolo[3,2-c]pyridine with MolForge

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Related Compounds

1-(4-acetylphenyl)ethanone;1-(1,1-difluoroethyl)-3-(trifluoromethyl)benzene-5-ide;3,6-dimethyl-[1]benzofuro[2,3-b]pyridine;6,9-dimethyl-3H-carbazol-3-ide;4,12-dimethyl-8-oxa-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-dimethyl-8-thia-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;2-methyl-5-phenylpyrazine;2-methyl-6-phenylpyrazine;5-methyl-8H-pyrido[4,3-b]indol-8-ide;tungsten
CID 158941711
20-(4-Methoxyphenyl)-18-methyl-10-oxa-17-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14(19),15,17,20-decaene;17-methyl-20-(9-phenylcarbazol-3-yl)-10-thia-15,18-diazapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene;15-methyl-20-[9-[4-(trifluoromethyl)phenyl]carbazol-3-yl]-10-thia-18-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene;12-(9-phenylcarbazol-2-yl)-23-oxa-4-azahexacyclo[12.11.0.02,11.05,10.016,24.017,22]pentacosa-1(25),2(11),3,5,7,9,12,14,16(24),17,19,21-dodecaene
CID 160627340
1-(4-acetylphenyl)ethanone;1,3-bis(trifluoromethyl)benzene-5-ide;3,6-dimethyl-[1]benzofuro[2,3-b]pyridine;6,9-dimethyl-3H-carbazol-3-ide;3,8-dimethyl-2,9-dihydro-1,10-phenanthroline-2,9-diide;4,12-dimethyl-8-oxa-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-dimethyl-8-thia-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;methane;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;3-methyl-2H-1,10-phenanthrolin-2-ide;2-methyl-5-phenylpyrazine;2-methyl-6-phenylpyrazine;2-methyl-5-phenylpyridine;5-methyl-8H-pyrido[4,3-b]indol-8-ide;tungsten
CID 161578898
9-[8-[3-(3-Dibenzofuran-2-ylphenyl)phenyl]dibenzothiophen-2-yl]pyrido[3,4-b]indole
CID 57544060
8-(3-Dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 57544260
4-[6-[6-[12-(2-Pyridin-4-ylphenyl)-8-thia-3,6,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-4-yl]dibenzofuran-4-yl]dibenzofuran-4-yl]-12-(2,4,6-tripyridin-4-ylphenyl)-8-thia-3,6,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene
CID 57958294
5-[8-[3-(8-Pyrido[3,2-b]indol-5-yldibenzofuran-2-yl)phenyl]dibenzothiophen-2-yl]pyrido[3,2-b]indole
CID 57958322
8-[3-[8-[4,6-Dimethyl-8-[3-(5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]dibenzofuran-2-yl]-4,6-dimethyldibenzothiophen-2-yl]phenyl]-5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 58501587
8-[8-[3-[8-(4,8,12-Triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]phenyl]dibenzothiophen-2-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 58511162
5-[(1Z,3E)-1-[5-[3-(8-pyrido[3,2-b]indol-5-yldibenzofuran-2-yl)phenyl]-1-benzothiophen-2-yl]penta-1,3-dien-3-yl]pyrido[3,2-b]indole
CID 88569208
8-(3-Dibenzofuran-2-ylcarbazol-9-yl)-[1]benzothiolo[3,2-b]pyridine
CID 89850154
6-(3-Dibenzofuran-2-ylcarbazol-9-yl)-[1]benzothiolo[2,3-b]pyridine
CID 89850155

Frequently Asked Questions

What is the IUPAC name of 6-[3-(5-dibenzofuran-2-ylthiophen-2-yl)carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;8-[3-(1-dibenzothiophen-2-ylcyclohexyl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-(8-dibenzothiophen-2-yldibenzofuran-2-yl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;6-[3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;6-[3-[[9-(2-methylphenyl)carbazol-3-yl]methyl]carbazol-9-yl]-[1]benzothiolo[2,3-c]pyridine;8-[3-[8-(5-methylpyrido[3,2-b]indol-8-yl)dibenzofuran-2-yl]carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]-[1]benzothiolo[3,2-c]pyridine?
The IUPAC name of 6-[3-(5-dibenzofuran-2-ylthiophen-2-yl)carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;8-[3-(1-dibenzothiophen-2-ylcyclohexyl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-(8-dibenzothiophen-2-yldibenzofuran-2-yl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;6-[3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;6-[3-[[9-(2-methylphenyl)carbazol-3-yl]methyl]carbazol-9-yl]-[1]benzothiolo[2,3-c]pyridine;8-[3-[8-(5-methylpyrido[3,2-b]indol-8-yl)dibenzofuran-2-yl]carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]-[1]benzothiolo[3,2-c]pyridine (CID 157449968) is 6-[3-(5-dibenzofuran-2-ylthiophen-2-yl)carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;8-[3-(1-dibenzothiophen-2-ylcyclohexyl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-(8-dibenzothiophen-2-yldibenzofuran-2-yl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;6-[3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;6-[3-[[9-(2-methylphenyl)carbazol-3-yl]methyl]carbazol-9-yl]-[1]benzothiolo[2,3-c]pyridine;8-[3-[8-(5-methylpyrido[3,2-b]indol-8-yl)dibenzofuran-2-yl]carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]-[1]benzothiolo[3,2-c]pyridine.
What is the SMILES notation for 6-[3-(5-dibenzofuran-2-ylthiophen-2-yl)carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;8-[3-(1-dibenzothiophen-2-ylcyclohexyl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-(8-dibenzothiophen-2-yldibenzofuran-2-yl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;6-[3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;6-[3-[[9-(2-methylphenyl)carbazol-3-yl]methyl]carbazol-9-yl]-[1]benzothiolo[2,3-c]pyridine;8-[3-[8-(5-methylpyrido[3,2-b]indol-8-yl)dibenzofuran-2-yl]carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]-[1]benzothiolo[3,2-c]pyridine?
The canonical SMILES for 6-[3-(5-dibenzofuran-2-ylthiophen-2-yl)carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;8-[3-(1-dibenzothiophen-2-ylcyclohexyl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-(8-dibenzothiophen-2-yldibenzofuran-2-yl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;6-[3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;6-[3-[[9-(2-methylphenyl)carbazol-3-yl]methyl]carbazol-9-yl]-[1]benzothiolo[2,3-c]pyridine;8-[3-[8-(5-methylpyrido[3,2-b]indol-8-yl)dibenzofuran-2-yl]carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]-[1]benzothiolo[3,2-c]pyridine is Cc1ccccc1-n1c2ccccc2c2cc(Cc3ccc4c(c3)c3ccccc3n4-c3ccc4sc5cnccc5c4c3)ccc21.Cn1c2ccc(-c3ccc4oc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccc7sc8cccnc8c7c6)cc5c4c3)cc2c2ncccc21.c1cc(-c2cccc(-c3cccc4c3sc3ccccc34)c2)cc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3sc4ncccc4c3c2)c1.c1ccc(-c2cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc(-c3ccc4c(c3)c3ccccc3n4-c3ccc4sc5ccncc5c4c3)c2)cc1.c1ccc2c(c1)oc1ccc(-c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5sc6ncccc6c5c4)s3)cc12.c1ccc2c(c1)sc1ccc(-c3ccc4oc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccc7sc8cccnc8c7c6)cc5c4c3)cc12.c1ccc2c(c1)sc1ccc(C3(c4ccc5c(c4)c4ccccc4n5-c4ccc5sc6cccnc6c5c4)CCCCC3)cc12.
What is the InChIKey of 6-[3-(5-dibenzofuran-2-ylthiophen-2-yl)carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;8-[3-(1-dibenzothiophen-2-ylcyclohexyl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-(8-dibenzothiophen-2-yldibenzofuran-2-yl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;6-[3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;6-[3-[[9-(2-methylphenyl)carbazol-3-yl]methyl]carbazol-9-yl]-[1]benzothiolo[2,3-c]pyridine;8-[3-[8-(5-methylpyrido[3,2-b]indol-8-yl)dibenzofuran-2-yl]carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]-[1]benzothiolo[3,2-c]pyridine?
The InChIKey is BSRKDXNHPVYQIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H33N3S.C47H28N4OS.C47H26N2OS2.C47H28N2S2.C43H29N3S.C41H30N2S2.C39H22N2OS2/c1-3-11-34(12-4-1)37-27-38(35-19-22-50-44(30-35)42-15-7-9-17-48(42)55(50)40-13-5-2-6-14-40)29-39(28-37)36-20-23-51-45(31-36)43-16-8-10-18-49(43)56(51)41-21-24-52-46(32-41)47-33-54-26-25-53(47)57-52;1-50-38-15-10-28(25-36(38)46-41(50)8-4-20-48-46)30-13-18-43-35(24-30)34-23-29(12-17-42(34)52-43)27-11-16-40-33(22-27)32-6-2-3-7-39(32)51(40)31-14-19-44-37(26-31)47-45(53-44)9-5-21-49-47;1-3-8-39-32(6-1)34-22-27(11-16-40(34)49(39)31-15-20-45-38(26-31)47-46(52-45)10-5-21-48-47)28-12-17-41-35(23-28)36-24-29(13-18-42(36)50-41)30-14-19-44-37(25-30)33-7-2-4-9-43(33)51-44;1-3-18-42-36(13-1)40-27-32(20-22-43(40)49(42)34-21-23-45-41(28-34)39-17-8-24-48-47(39)51-45)30-10-5-9-29(25-30)31-11-6-12-33(26-31)35-15-7-16-38-37-14-2-4-19-44(37)50-46(35)38;1-27-8-2-5-11-37(27)46-39-13-7-4-10-32(39)35-24-29(15-18-41(35)46)22-28-14-17-40-34(23-28)31-9-3-6-12-38(31)45(40)30-16-19-42-36(25-30)33-20-21-44-26-43(33)47-42;1-6-20-41(21-7-1,27-15-18-37-32(24-27)30-10-3-5-12-36(30)44-37)26-14-17-35-31(23-26)29-9-2-4-11-34(29)43(35)28-16-19-38-33(25-28)40-39(45-38)13-8-22-42-40;1-3-9-32-26(6-1)29-20-23(11-14-33(29)41(32)25-13-16-38-31(22-25)28-8-5-19-40-39(28)44-38)36-17-18-37(43-36)24-12-15-35-30(21-24)27-7-2-4-10-34(27)42-35/h1-33H;2-26H,1H3;1-26H;1-28H;2-21,23-26H,22H2,1H3;2-5,8-19,22-25H,1,6-7,20-21H2;1-22H.
What are the key properties of 6-[3-(5-dibenzofuran-2-ylthiophen-2-yl)carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;8-[3-(1-dibenzothiophen-2-ylcyclohexyl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-(8-dibenzothiophen-2-yldibenzofuran-2-yl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;6-[3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;6-[3-[[9-(2-methylphenyl)carbazol-3-yl]methyl]carbazol-9-yl]-[1]benzothiolo[2,3-c]pyridine;8-[3-[8-(5-methylpyrido[3,2-b]indol-8-yl)dibenzofuran-2-yl]carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]-[1]benzothiolo[3,2-c]pyridine?
6-[3-(5-dibenzofuran-2-ylthiophen-2-yl)carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;8-[3-(1-dibenzothiophen-2-ylcyclohexyl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-(8-dibenzothiophen-2-yldibenzofuran-2-yl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;6-[3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;6-[3-[[9-(2-methylphenyl)carbazol-3-yl]methyl]carbazol-9-yl]-[1]benzothiolo[2,3-c]pyridine;8-[3-[8-(5-methylpyrido[3,2-b]indol-8-yl)dibenzofuran-2-yl]carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]-[1]benzothiolo[3,2-c]pyridine has a molecular weight of 4657.91 g/mol, XLogP of 91.08, 25 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(5-dibenzofuran-2-ylthiophen-2-yl)carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;8-[3-(1-dibenzothiophen-2-ylcyclohexyl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-(8-dibenzothiophen-2-yldibenzofuran-2-yl)carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;6-[3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazol-9-yl]-[1]benzothiolo[2,3-b]pyridine;6-[3-[[9-(2-methylphenyl)carbazol-3-yl]methyl]carbazol-9-yl]-[1]benzothiolo[2,3-c]pyridine;8-[3-[8-(5-methylpyrido[3,2-b]indol-8-yl)dibenzofuran-2-yl]carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]-[1]benzothiolo[3,2-c]pyridine is sourced from PubChem (CID 157449968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).