7-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]quinoline;6-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]benzimidazolo[1,2-c]quinazoline;2-[4-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]phenyl]-1-phenylbenzimidazole;2-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]-4-phenylquinoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-4-phenylquinoline;4-phenyl-2-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]quinazoline

C268H162N26OS7 — CID 157094150

IUPAC7-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]quinoline;6-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]benzimidazolo[1,2-c]quinazoline;2-[4-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]phenyl]-1-phenylbenzimidazole;2-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]-4-phenylquinoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-4-phenylquinoline;4-phenyl-2-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]quinazoline
SMILESc1ccc(-c2cc(-c3cccc4sc5c(-c6cc(-c7ccccc7)c7ccccc7n6)cccc5c34)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3cccc4sc5c(-c6ccc(-c7nc8ccccc8n7-c7ccccc7)cc6)cccc5c34)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4cccc5sc6c(-c7nc(-c8ccccc8)c8ccccc8n7)cccc6c45)n3)c2)cc1.c1ccc(-c2nc(-c3cccc4c3oc3ccccc34)nc(-c3cccc4sc5c(-c6ccc7cccnc7c6)cccc5c34)n2)cc1.c1ccc(-c2nc(-c3cccc4c3sc3ccccc34)nc(-c3cccc4sc5c(-c6nc7ccccc7c7nc8ccccc8n67)cccc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4sc5c(-c6cc(-c7ccccc7)c7ccccc7n6)cccc5c34)n2)cc1
InChIInChI=1S/C47H26N6S2.C47H29N5S.C47H30N4S.C43H27N3S.C42H24N4OS.C42H26N4S/c1-2-13-27(14-3-1)43-50-44(52-45(51-43)33-20-10-17-29-28-15-5-9-25-38(28)54-41(29)33)32-19-12-26-39-40(32)31-18-11-21-34(42(31)55-39)47-48-35-22-6-4-16-30(35)46-49-36-23-7-8-24-37(36)53(46)47;1-4-15-30(16-5-1)33-21-12-22-34(29-33)45-50-44(32-19-8-3-9-20-32)51-46(52-45)37-25-14-28-40-41(37)36-24-13-26-38(43(36)53-40)47-48-39-27-11-10-23-35(39)42(49-47)31-17-6-2-7-18-31;1-4-14-32(15-5-1)40-30-41(49-46(48-40)33-16-6-2-7-17-33)37-21-13-25-43-44(37)38-22-12-20-36(45(38)52-43)31-26-28-34(29-27-31)47-50-39-23-10-11-24-42(39)51(47)35-18-8-3-9-19-35;1-4-14-28(15-5-1)35-26-38(44-36-24-11-10-20-31(35)36)33-22-12-23-34-41-32(21-13-25-40(41)47-42(33)34)39-27-37(29-16-6-2-7-17-29)45-43(46-39)30-18-8-3-9-19-30;1-2-10-26(11-3-1)40-44-41(46-42(45-40)33-18-7-15-30-29-13-4-5-19-35(29)47-38(30)33)32-17-8-20-36-37(32)31-16-6-14-28(39(31)48-36)27-22-21-25-12-9-23-43-34(25)24-27;1-4-14-27(15-5-1)34-26-36(43-35-24-11-10-20-30(34)35)31-21-12-22-32-38-33(23-13-25-37(38)47-39(31)32)42-45-40(28-16-6-2-7-17-28)44-41(46-42)29-18-8-3-9-19-29/h1-26H;1-29H;1-30H;1-27H;1-24H;1-26H
InChIKeyAEZYTKVOCNAMSB-UHFFFAOYSA-N
MW3986.89 g/mol
LogP71.53
Rot. Bonds30

About 7-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]quinoline;6-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]benzimidazolo[1,2-c]quinazoline;2-[4-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]phenyl]-1-phenylbenzimidazole;2-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]-4-phenylquinoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-4-phenylquinoline;4-phenyl-2-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]quinazoline

7-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]quinoline;6-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]benzimidazolo[1,2-c]quinazoline;2-[4-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]phenyl]-1-phenylbenzimidazole;2-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]-4-phenylquinoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-4-phenylquinoline;4-phenyl-2-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]quinazoline (PubChem CID 157094150) has the molecular formula C268H162N26OS7 and a molecular weight of 3986.89 g/mol. Its IUPAC name is 7-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]quinoline;6-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]benzimidazolo[1,2-c]quinazoline;2-[4-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]phenyl]-1-phenylbenzimidazole;2-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]-4-phenylquinoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-4-phenylquinoline;4-phenyl-2-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]quinazoline.

Molecular Properties

Compound Name7-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]quinoline;6-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]benzimidazolo[1,2-c]quinazoline;2-[4-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]phenyl]-1-phenylbenzimidazole;2-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]-4-phenylquinoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-4-phenylquinoline;4-phenyl-2-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]quinazoline
PubChem CID157094150
Molecular FormulaC268H162N26OS7
Molecular Weight3986.89 g/mol
Exact Mass3983.15
IUPAC Name7-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]quinoline;6-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]benzimidazolo[1,2-c]quinazoline;2-[4-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]phenyl]-1-phenylbenzimidazole;2-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]-4-phenylquinoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-4-phenylquinoline;4-phenyl-2-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]quinazoline
SMILESc1ccc(-c2cc(-c3cccc4sc5c(-c6cc(-c7ccccc7)c7ccccc7n6)cccc5c34)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3cccc4sc5c(-c6ccc(-c7nc8ccccc8n7-c7ccccc7)cc6)cccc5c34)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4cccc5sc6c(-c7nc(-c8ccccc8)c8ccccc8n7)cccc6c45)n3)c2)cc1.c1ccc(-c2nc(-c3cccc4c3oc3ccccc34)nc(-c3cccc4sc5c(-c6ccc7cccnc7c6)cccc5c34)n2)cc1.c1ccc(-c2nc(-c3cccc4c3sc3ccccc34)nc(-c3cccc4sc5c(-c6nc7ccccc7c7nc8ccccc8n67)cccc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4sc5c(-c6cc(-c7ccccc7)c7ccccc7n6)cccc5c34)n2)cc1
InChIInChI=1S/C47H26N6S2.C47H29N5S.C47H30N4S.C43H27N3S.C42H24N4OS.C42H26N4S/c1-2-13-27(14-3-1)43-50-44(52-45(51-43)33-20-10-17-29-28-15-5-9-25-38(28)54-41(29)33)32-19-12-26-39-40(32)31-18-11-21-34(42(31)55-39)47-48-35-22-6-4-16-30(35)46-49-36-23-7-8-24-37(36)53(46)47;1-4-15-30(16-5-1)33-21-12-22-34(29-33)45-50-44(32-19-8-3-9-20-32)51-46(52-45)37-25-14-28-40-41(37)36-24-13-26-38(43(36)53-40)47-48-39-27-11-10-23-35(39)42(49-47)31-17-6-2-7-18-31;1-4-14-32(15-5-1)40-30-41(49-46(48-40)33-16-6-2-7-17-33)37-21-13-25-43-44(37)38-22-12-20-36(45(38)52-43)31-26-28-34(29-27-31)47-50-39-23-10-11-24-42(39)51(47)35-18-8-3-9-19-35;1-4-14-28(15-5-1)35-26-38(44-36-24-11-10-20-31(35)36)33-22-12-23-34-41-32(21-13-25-40(41)47-42(33)34)39-27-37(29-16-6-2-7-17-29)45-43(46-39)30-18-8-3-9-19-30;1-2-10-26(11-3-1)40-44-41(46-42(45-40)33-18-7-15-30-29-13-4-5-19-35(29)47-38(30)33)32-17-8-20-36-37(32)31-16-6-14-28(39(31)48-36)27-22-21-25-12-9-23-43-34(25)24-27;1-4-14-27(15-5-1)34-26-36(43-35-24-11-10-20-30(34)35)31-21-12-22-32-38-33(23-13-25-37(38)47-39(31)32)42-45-40(28-16-6-2-7-17-28)44-41(46-42)29-18-8-3-9-19-29/h1-26H;1-29H;1-30H;1-27H;1-24H;1-26H
InChIKeyAEZYTKVOCNAMSB-UHFFFAOYSA-N
XLogP71.53
TPSA331.84 Ų
H-Bond Donors
H-Bond Acceptors34
Rotatable Bonds30
Heavy Atoms302
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003986.89
LogP ≤ 571.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1034

Analyze 7-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]quinoline;6-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]benzimidazolo[1,2-c]quinazoline;2-[4-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]phenyl]-1-phenylbenzimidazole;2-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]-4-phenylquinoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-4-phenylquinoline;4-phenyl-2-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]quinazoline with MolForge

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Related Compounds

2-[7-[4-[4-dibenzofuran-4-yl-6-(9-isoquinolin-3-yldibenzothiophen-1-yl)-1,3,5-triazin-2-yl]phenyl]-9-[4-(3-phenylphenyl)-6-[4-[3-[4-phenyl-6-[9-[3-(1-phenylbenzimidazol-2-yl)phenyl]dibenzothiophen-1-yl]pyrimidin-2-yl]phenyl]phenyl]-1,3,5-triazin-2-yl]dibenzothiophen-1-yl]-4-phenylquinazoline
CID 154939357
2-[9-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-1-phenylbenzimidazole
CID 146917038
3-[4,6-bis(1,2-diphenylbenzimidazol-5-yl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-[4-[4,6-bis(1,2-diphenylbenzimidazol-5-yl)-1,3,5-triazin-2-yl]phenyl]carbazole;5-[4-dibenzofuran-4-yl-6-(1,2-diphenylbenzimidazol-5-yl)-1,3,5-triazin-2-yl]-1,2-diphenylbenzimidazole;5-[4-dibenzothiophen-4-yl-6-(1,2-diphenylbenzimidazol-5-yl)-1,3,5-triazin-2-yl]-1,2-diphenylbenzimidazole;5-[4-(9,9-dimethylfluoren-2-yl)-6-(1,2-diphenylbenzimidazol-5-yl)-1,3,5-triazin-2-yl]-1,2-diphenylbenzimidazole;1,2-diphenyl-5-[4-[4-phenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole
CID 159852810
3,9-diphenyl-6-[6-(1-phenylbenzimidazol-2-yl)dibenzofuran-4-yl]carbazole;3,9-diphenyl-6-[6-(2-phenylbenzimidazol-1-yl)dibenzofuran-4-yl]carbazole;3,9-diphenyl-6-[6-(1-phenylbenzimidazol-2-yl)dibenzothiophen-4-yl]carbazole;3,9-diphenyl-6-[6-(4-phenylquinazolin-2-yl)dibenzofuran-4-yl]carbazole;3-[6-(2,6-diphenylpyrimidin-4-yl)dibenzofuran-4-yl]-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole;3-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole
CID 162184033
2-[9-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-1-phenylbenzimidazole;2-[9-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-1-phenylbenzimidazole;2-[9-(4-dibenzothiophen-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-1-phenylbenzimidazole
CID 160957839
2-[4-[6-[3-(4-dibenzothiophen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]dibenzothiophen-2-yl]phenyl]-1-phenylbenzimidazole
CID 155356641
2-[3-[3-(4-dibenzofuran-4-ylphenyl)phenyl]phenyl]-4,9-diphenylpyrimido[4,5-b]indole;2-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-9-phenyl-4-(3-phenylphenyl)pyrimido[4,5-b]indole;2-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]-9-phenyl-4-(3-phenylphenyl)pyrimido[4,5-b]indole
CID 158442351
1-phenyl-2-[9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)pyrimidin-2-yl]dibenzothiophen-4-yl]benzimidazole
CID 147237634
2-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-9-phenylcarbazole
CID 168768047
2-[4-(3-benzo[h]quinolin-6-ylphenyl)phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine;6-[3-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]benzo[h]quinoline;6-[3-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]benzo[h]quinoline
CID 158292757
2-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-1-phenylbenzimidazole;2-[9-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-1-phenylbenzimidazole;2-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-1-phenylbenzimidazole
CID 158170833
2-dibenzofuran-4-yl-3-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-4-phenylthieno[3,2-c]quinoline;2-dibenzofuran-4-yl-3-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-4-phenylthieno[3,2-c]quinoline;2-dibenzofuran-4-yl-4-phenyl-3-[4-(1-phenylbenzimidazol-2-yl)phenyl]thieno[3,2-c]quinoline
CID 164951892

Frequently Asked Questions

What is the IUPAC name of 7-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]quinoline;6-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]benzimidazolo[1,2-c]quinazoline;2-[4-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]phenyl]-1-phenylbenzimidazole;2-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]-4-phenylquinoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-4-phenylquinoline;4-phenyl-2-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]quinazoline?
The IUPAC name of 7-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]quinoline;6-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]benzimidazolo[1,2-c]quinazoline;2-[4-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]phenyl]-1-phenylbenzimidazole;2-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]-4-phenylquinoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-4-phenylquinoline;4-phenyl-2-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]quinazoline (CID 157094150) is 7-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]quinoline;6-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]benzimidazolo[1,2-c]quinazoline;2-[4-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]phenyl]-1-phenylbenzimidazole;2-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]-4-phenylquinoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-4-phenylquinoline;4-phenyl-2-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]quinazoline.
What is the SMILES notation for 7-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]quinoline;6-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]benzimidazolo[1,2-c]quinazoline;2-[4-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]phenyl]-1-phenylbenzimidazole;2-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]-4-phenylquinoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-4-phenylquinoline;4-phenyl-2-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]quinazoline?
The canonical SMILES for 7-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]quinoline;6-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]benzimidazolo[1,2-c]quinazoline;2-[4-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]phenyl]-1-phenylbenzimidazole;2-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]-4-phenylquinoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-4-phenylquinoline;4-phenyl-2-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]quinazoline is c1ccc(-c2cc(-c3cccc4sc5c(-c6cc(-c7ccccc7)c7ccccc7n6)cccc5c34)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3cccc4sc5c(-c6ccc(-c7nc8ccccc8n7-c7ccccc7)cc6)cccc5c34)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4cccc5sc6c(-c7nc(-c8ccccc8)c8ccccc8n7)cccc6c45)n3)c2)cc1.c1ccc(-c2nc(-c3cccc4c3oc3ccccc34)nc(-c3cccc4sc5c(-c6ccc7cccnc7c6)cccc5c34)n2)cc1.c1ccc(-c2nc(-c3cccc4c3sc3ccccc34)nc(-c3cccc4sc5c(-c6nc7ccccc7c7nc8ccccc8n67)cccc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4sc5c(-c6cc(-c7ccccc7)c7ccccc7n6)cccc5c34)n2)cc1.
What is the InChIKey of 7-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]quinoline;6-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]benzimidazolo[1,2-c]quinazoline;2-[4-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]phenyl]-1-phenylbenzimidazole;2-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]-4-phenylquinoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-4-phenylquinoline;4-phenyl-2-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]quinazoline?
The InChIKey is AEZYTKVOCNAMSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C47H26N6S2.C47H29N5S.C47H30N4S.C43H27N3S.C42H24N4OS.C42H26N4S/c1-2-13-27(14-3-1)43-50-44(52-45(51-43)33-20-10-17-29-28-15-5-9-25-38(28)54-41(29)33)32-19-12-26-39-40(32)31-18-11-21-34(42(31)55-39)47-48-35-22-6-4-16-30(35)46-49-36-23-7-8-24-37(36)53(46)47;1-4-15-30(16-5-1)33-21-12-22-34(29-33)45-50-44(32-19-8-3-9-20-32)51-46(52-45)37-25-14-28-40-41(37)36-24-13-26-38(43(36)53-40)47-48-39-27-11-10-23-35(39)42(49-47)31-17-6-2-7-18-31;1-4-14-32(15-5-1)40-30-41(49-46(48-40)33-16-6-2-7-17-33)37-21-13-25-43-44(37)38-22-12-20-36(45(38)52-43)31-26-28-34(29-27-31)47-50-39-23-10-11-24-42(39)51(47)35-18-8-3-9-19-35;1-4-14-28(15-5-1)35-26-38(44-36-24-11-10-20-31(35)36)33-22-12-23-34-41-32(21-13-25-40(41)47-42(33)34)39-27-37(29-16-6-2-7-17-29)45-43(46-39)30-18-8-3-9-19-30;1-2-10-26(11-3-1)40-44-41(46-42(45-40)33-18-7-15-30-29-13-4-5-19-35(29)47-38(30)33)32-17-8-20-36-37(32)31-16-6-14-28(39(31)48-36)27-22-21-25-12-9-23-43-34(25)24-27;1-4-14-27(15-5-1)34-26-36(43-35-24-11-10-20-30(34)35)31-21-12-22-32-38-33(23-13-25-37(38)47-39(31)32)42-45-40(28-16-6-2-7-17-28)44-41(46-42)29-18-8-3-9-19-29/h1-26H;1-29H;1-30H;1-27H;1-24H;1-26H.
What are the key properties of 7-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]quinoline;6-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]benzimidazolo[1,2-c]quinazoline;2-[4-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]phenyl]-1-phenylbenzimidazole;2-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]-4-phenylquinoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-4-phenylquinoline;4-phenyl-2-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]quinazoline?
7-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]quinoline;6-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]benzimidazolo[1,2-c]quinazoline;2-[4-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]phenyl]-1-phenylbenzimidazole;2-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]-4-phenylquinoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-4-phenylquinoline;4-phenyl-2-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]quinazoline has a molecular weight of 3986.89 g/mol, XLogP of 71.53, 30 rotatable bonds, 0 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]quinoline;6-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]benzimidazolo[1,2-c]quinazoline;2-[4-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]phenyl]-1-phenylbenzimidazole;2-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]-4-phenylquinoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-4-phenylquinoline;4-phenyl-2-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]quinazoline is sourced from PubChem (CID 157094150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).