2-dibenzofuran-2-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;2-dibenzofuran-3-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(3-phenylisoquinolin-1-yl)-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(4-phenylquinolin-2-yl)-[1]benzothiolo[3,2-c]carbazole

C180H108N12O2S4 — CID 158009782

IUPAC2-dibenzofuran-2-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;2-dibenzofuran-3-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(3-phenylisoquinolin-1-yl)-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(4-phenylquinolin-2-yl)-[1]benzothiolo[3,2-c]carbazole
SMILESc1ccc(-c2cc(-c3cccc4c3sc3c4ccc4c3c3ccccc3n4-c3ccccc3)nc3ccccc23)cc1.c1ccc(-c2cc3ccccc3c(-c3cccc4c3sc3c4ccc4c3c3ccccc3n4-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3sc3c4ccc4c3c3cc(-c5ccc6c(c5)oc5ccccc56)ccc3n4-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3sc3c4ccc4c3c3cc(-c5ccc6oc7ccccc7c6c5)ccc3n4-c3ccccc3)n2)cc1
InChIInChI=1S/2C51H30N4OS.2C39H24N2S/c1-4-13-31(14-5-1)49-52-50(32-15-6-2-7-16-32)54-51(53-49)39-21-12-20-37-38-25-27-43-46(48(38)57-47(37)39)41-30-33(23-26-42(41)55(43)35-17-8-3-9-18-35)34-24-28-45-40(29-34)36-19-10-11-22-44(36)56-45;1-4-13-31(14-5-1)49-52-50(32-15-6-2-7-16-32)54-51(53-49)40-21-12-20-38-39-26-28-43-46(48(39)57-47(38)40)41-29-33(24-27-42(41)55(43)35-17-8-3-9-18-35)34-23-25-37-36-19-10-11-22-44(36)56-45(37)30-34;1-3-12-25(13-4-1)32-24-34(40-33-20-9-7-16-27(32)33)30-19-11-18-28-29-22-23-36-37(39(29)42-38(28)30)31-17-8-10-21-35(31)41(36)26-14-5-2-6-15-26;1-3-12-25(13-4-1)33-24-26-14-7-8-17-28(26)37(40-33)32-20-11-19-29-30-22-23-35-36(39(30)42-38(29)32)31-18-9-10-21-34(31)41(35)27-15-5-2-6-16-27/h2*1-30H;2*1-24H
InChIKeyFESXBNXRSYSRHP-UHFFFAOYSA-N
MW2599.19 g/mol
LogP49.88
Rot. Bonds16

About 2-dibenzofuran-2-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;2-dibenzofuran-3-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(3-phenylisoquinolin-1-yl)-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(4-phenylquinolin-2-yl)-[1]benzothiolo[3,2-c]carbazole

2-dibenzofuran-2-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;2-dibenzofuran-3-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(3-phenylisoquinolin-1-yl)-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(4-phenylquinolin-2-yl)-[1]benzothiolo[3,2-c]carbazole (PubChem CID 158009782) has the molecular formula C180H108N12O2S4 and a molecular weight of 2599.19 g/mol. Its IUPAC name is 2-dibenzofuran-2-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;2-dibenzofuran-3-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(3-phenylisoquinolin-1-yl)-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(4-phenylquinolin-2-yl)-[1]benzothiolo[3,2-c]carbazole.

Molecular Properties

Compound Name2-dibenzofuran-2-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;2-dibenzofuran-3-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(3-phenylisoquinolin-1-yl)-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(4-phenylquinolin-2-yl)-[1]benzothiolo[3,2-c]carbazole
PubChem CID158009782
Molecular FormulaC180H108N12O2S4
Molecular Weight2599.19 g/mol
Exact Mass2596.76
IUPAC Name2-dibenzofuran-2-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;2-dibenzofuran-3-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(3-phenylisoquinolin-1-yl)-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(4-phenylquinolin-2-yl)-[1]benzothiolo[3,2-c]carbazole
SMILESc1ccc(-c2cc(-c3cccc4c3sc3c4ccc4c3c3ccccc3n4-c3ccccc3)nc3ccccc23)cc1.c1ccc(-c2cc3ccccc3c(-c3cccc4c3sc3c4ccc4c3c3ccccc3n4-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3sc3c4ccc4c3c3cc(-c5ccc6c(c5)oc5ccccc56)ccc3n4-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3sc3c4ccc4c3c3cc(-c5ccc6oc7ccccc7c6c5)ccc3n4-c3ccccc3)n2)cc1
InChIInChI=1S/2C51H30N4OS.2C39H24N2S/c1-4-13-31(14-5-1)49-52-50(32-15-6-2-7-16-32)54-51(53-49)39-21-12-20-37-38-25-27-43-46(48(38)57-47(37)39)41-30-33(23-26-42(41)55(43)35-17-8-3-9-18-35)34-24-28-45-40(29-34)36-19-10-11-22-44(36)56-45;1-4-13-31(14-5-1)49-52-50(32-15-6-2-7-16-32)54-51(53-49)40-21-12-20-38-39-26-28-43-46(48(39)57-47(38)40)41-29-33(24-27-42(41)55(43)35-17-8-3-9-18-35)34-23-25-37-36-19-10-11-22-44(36)56-45(37)30-34;1-3-12-25(13-4-1)32-24-34(40-33-20-9-7-16-27(32)33)30-19-11-18-28-29-22-23-36-37(39(29)42-38(28)30)31-17-8-10-21-35(31)41(36)26-14-5-2-6-15-26;1-3-12-25(13-4-1)33-24-26-14-7-8-17-28(26)37(40-33)32-20-11-19-29-30-22-23-35-36(39(30)42-38(29)32)31-18-9-10-21-34(31)41(35)27-15-5-2-6-16-27/h2*1-30H;2*1-24H
InChIKeyFESXBNXRSYSRHP-UHFFFAOYSA-N
XLogP49.88
TPSA149.12 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds16
Heavy Atoms198
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002599.19
LogP ≤ 549.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 2-dibenzofuran-2-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;2-dibenzofuran-3-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(3-phenylisoquinolin-1-yl)-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(4-phenylquinolin-2-yl)-[1]benzothiolo[3,2-c]carbazole with MolForge

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Related Compounds

11-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,5-diphenyl-[1]benzothiolo[3,2-c]carbazole
CID 158699020
5-dibenzofuran-3-yl-11-(2,6-diphenylpyrimidin-4-yl)-[1]benzothiolo[3,2-c]carbazole
CID 146541929
9-phenyl-3-[9-[4-phenyl-6-(6-phenyldibenzothiophen-4-yl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]carbazole
CID 129291950
4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-9-phenylcarbazole
CID 154602275
2-naphthalen-1-yl-5-phenyl-11-(2-phenylquinolin-4-yl)-[1]benzothiolo[3,2-c]carbazole
CID 146541978
4-[9-(2-dibenzofuran-3-yl-6-phenylpyrimidin-4-yl)dibenzofuran-2-yl]-9-phenylcarbazole
CID 168768741
2-dibenzofuran-3-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzofuro[3,2-c]carbazole
CID 146541281
3-[3-(4-dibenzofuran-3-yl-6-phenylpyrimidin-2-yl)phenyl]-9-phenylcarbazole;4-[3-(4-dibenzofuran-3-yl-6-phenylpyrimidin-2-yl)phenyl]-9-phenylcarbazole;9-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-2-phenylcarbazole;9-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-4-phenylcarbazole
CID 159581525
3-[4-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]carbazol-9-yl]-9-phenylcarbazole;3-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-9-(9-phenylcarbazol-3-yl)carbazole;9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-(4-phenylquinazolin-2-yl)dibenzofuran-2-yl]carbazole
CID 162231270
11-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole
CID 146541392
2-phenyl-4-(5-phenyl-[1]benzothiolo[3,2-c]carbazol-11-yl)-[1]benzofuro[3,2-d]pyrimidine
CID 122634799
2-dibenzofuran-3-yl-4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-2-yl-4-(4-naphthalen-2-ylphenyl)-6-phenyl-1,3,5-triazine;3-[2-(3-dibenzofuran-3-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]benzonitrile;9-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;2,4-diphenyl-6-[3-[6-(4-phenylphenyl)dibenzothiophen-4-yl]phenyl]-1,3,5-triazine;3-phenyl-9-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 158866794

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-2-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;2-dibenzofuran-3-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(3-phenylisoquinolin-1-yl)-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(4-phenylquinolin-2-yl)-[1]benzothiolo[3,2-c]carbazole?
The IUPAC name of 2-dibenzofuran-2-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;2-dibenzofuran-3-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(3-phenylisoquinolin-1-yl)-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(4-phenylquinolin-2-yl)-[1]benzothiolo[3,2-c]carbazole (CID 158009782) is 2-dibenzofuran-2-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;2-dibenzofuran-3-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(3-phenylisoquinolin-1-yl)-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(4-phenylquinolin-2-yl)-[1]benzothiolo[3,2-c]carbazole.
What is the SMILES notation for 2-dibenzofuran-2-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;2-dibenzofuran-3-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(3-phenylisoquinolin-1-yl)-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(4-phenylquinolin-2-yl)-[1]benzothiolo[3,2-c]carbazole?
The canonical SMILES for 2-dibenzofuran-2-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;2-dibenzofuran-3-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(3-phenylisoquinolin-1-yl)-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(4-phenylquinolin-2-yl)-[1]benzothiolo[3,2-c]carbazole is c1ccc(-c2cc(-c3cccc4c3sc3c4ccc4c3c3ccccc3n4-c3ccccc3)nc3ccccc23)cc1.c1ccc(-c2cc3ccccc3c(-c3cccc4c3sc3c4ccc4c3c3ccccc3n4-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3sc3c4ccc4c3c3cc(-c5ccc6c(c5)oc5ccccc56)ccc3n4-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3sc3c4ccc4c3c3cc(-c5ccc6oc7ccccc7c6c5)ccc3n4-c3ccccc3)n2)cc1.
What is the InChIKey of 2-dibenzofuran-2-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;2-dibenzofuran-3-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(3-phenylisoquinolin-1-yl)-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(4-phenylquinolin-2-yl)-[1]benzothiolo[3,2-c]carbazole?
The InChIKey is FESXBNXRSYSRHP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C51H30N4OS.2C39H24N2S/c1-4-13-31(14-5-1)49-52-50(32-15-6-2-7-16-32)54-51(53-49)39-21-12-20-37-38-25-27-43-46(48(38)57-47(37)39)41-30-33(23-26-42(41)55(43)35-17-8-3-9-18-35)34-24-28-45-40(29-34)36-19-10-11-22-44(36)56-45;1-4-13-31(14-5-1)49-52-50(32-15-6-2-7-16-32)54-51(53-49)40-21-12-20-38-39-26-28-43-46(48(39)57-47(38)40)41-29-33(24-27-42(41)55(43)35-17-8-3-9-18-35)34-23-25-37-36-19-10-11-22-44(36)56-45(37)30-34;1-3-12-25(13-4-1)32-24-34(40-33-20-9-7-16-27(32)33)30-19-11-18-28-29-22-23-36-37(39(29)42-38(28)30)31-17-8-10-21-35(31)41(36)26-14-5-2-6-15-26;1-3-12-25(13-4-1)33-24-26-14-7-8-17-28(26)37(40-33)32-20-11-19-29-30-22-23-35-36(39(30)42-38(29)32)31-18-9-10-21-34(31)41(35)27-15-5-2-6-16-27/h2*1-30H;2*1-24H.
What are the key properties of 2-dibenzofuran-2-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;2-dibenzofuran-3-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(3-phenylisoquinolin-1-yl)-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(4-phenylquinolin-2-yl)-[1]benzothiolo[3,2-c]carbazole?
2-dibenzofuran-2-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;2-dibenzofuran-3-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(3-phenylisoquinolin-1-yl)-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(4-phenylquinolin-2-yl)-[1]benzothiolo[3,2-c]carbazole has a molecular weight of 2599.19 g/mol, XLogP of 49.88, 16 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-2-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;2-dibenzofuran-3-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(3-phenylisoquinolin-1-yl)-[1]benzothiolo[3,2-c]carbazole;5-phenyl-11-(4-phenylquinolin-2-yl)-[1]benzothiolo[3,2-c]carbazole is sourced from PubChem (CID 158009782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).