About 2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-(4-fluorophenyl)-[1]benzothiolo[3,2-d]pyrimidine;2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-phenyl-[1]benzofuro[3,2-d]pyrimidine;2-[3-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-[4-(4-methylphenyl)-5-phenylsulfanylpyrimidin-2-yl]dibenzothiophen-3-yl]-4,6-diphenyl-1,3,5-triazine
2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-(4-fluorophenyl)-[1]benzothiolo[3,2-d]pyrimidine;2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-phenyl-[1]benzofuro[3,2-d]pyrimidine;2-[3-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-[4-(4-methylphenyl)-5-phenylsulfanylpyrimidin-2-yl]dibenzothiophen-3-yl]-4,6-diphenyl-1,3,5-triazine (PubChem CID 157148745) has the molecular formula C179H107FN20OS7
and a molecular weight of 2797.43 g/mol. Its IUPAC name is 2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-(4-fluorophenyl)-[1]benzothiolo[3,2-d]pyrimidine;2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-phenyl-[1]benzofuro[3,2-d]pyrimidine;2-[3-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-[4-(4-methylphenyl)-5-phenylsulfanylpyrimidin-2-yl]dibenzothiophen-3-yl]-4,6-diphenyl-1,3,5-triazine.
Frequently Asked Questions
What is the IUPAC name of 2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-(4-fluorophenyl)-[1]benzothiolo[3,2-d]pyrimidine;2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-phenyl-[1]benzofuro[3,2-d]pyrimidine;2-[3-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-[4-(4-methylphenyl)-5-phenylsulfanylpyrimidin-2-yl]dibenzothiophen-3-yl]-4,6-diphenyl-1,3,5-triazine?
The IUPAC name of 2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-(4-fluorophenyl)-[1]benzothiolo[3,2-d]pyrimidine;2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-phenyl-[1]benzofuro[3,2-d]pyrimidine;2-[3-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-[4-(4-methylphenyl)-5-phenylsulfanylpyrimidin-2-yl]dibenzothiophen-3-yl]-4,6-diphenyl-1,3,5-triazine (CID 157148745) is 2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-(4-fluorophenyl)-[1]benzothiolo[3,2-d]pyrimidine;2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-phenyl-[1]benzofuro[3,2-d]pyrimidine;2-[3-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-[4-(4-methylphenyl)-5-phenylsulfanylpyrimidin-2-yl]dibenzothiophen-3-yl]-4,6-diphenyl-1,3,5-triazine.
What is the SMILES notation for 2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-(4-fluorophenyl)-[1]benzothiolo[3,2-d]pyrimidine;2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-phenyl-[1]benzofuro[3,2-d]pyrimidine;2-[3-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-[4-(4-methylphenyl)-5-phenylsulfanylpyrimidin-2-yl]dibenzothiophen-3-yl]-4,6-diphenyl-1,3,5-triazine?
The canonical SMILES for 2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-(4-fluorophenyl)-[1]benzothiolo[3,2-d]pyrimidine;2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-phenyl-[1]benzofuro[3,2-d]pyrimidine;2-[3-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-[4-(4-methylphenyl)-5-phenylsulfanylpyrimidin-2-yl]dibenzothiophen-3-yl]-4,6-diphenyl-1,3,5-triazine is Cc1ccc(-c2nc(-c3ccc4sc5cc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)ccc5c4c3)ncc2Sc2ccccc2)cc1.Fc1ccc(-c2nc(-c3ccc4sc5cc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)ccc5c4c3)nc3c2sc2ccccc23)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c(c3)sc3ccc(-c5cccc(-c6nc(-c7ccccc7)c7sc8ccccc8c7n6)c5)cc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c(c3)sc3ccc(-c5nc(-c6ccccc6)c6oc7ccccc7c6n5)cc34)n2)cc1.
What is the InChIKey of 2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-(4-fluorophenyl)-[1]benzothiolo[3,2-d]pyrimidine;2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-phenyl-[1]benzofuro[3,2-d]pyrimidine;2-[3-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-[4-(4-methylphenyl)-5-phenylsulfanylpyrimidin-2-yl]dibenzothiophen-3-yl]-4,6-diphenyl-1,3,5-triazine?
The InChIKey is AKZXJVRVYNRYTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H29N5S2.C44H29N5S2.C43H24FN5S2.C43H25N5OS/c1-4-13-30(14-5-1)43-45-44(38-21-10-11-22-40(38)56-45)51-48(50-43)35-20-12-19-33(27-35)34-24-26-41-39(28-34)37-25-23-36(29-42(37)55-41)49-53-46(31-15-6-2-7-16-31)52-47(54-49)32-17-8-3-9-18-32;1-28-17-19-29(20-18-28)40-39(50-34-15-9-4-10-16-34)27-45-41(46-40)32-22-24-37-36(25-32)35-23-21-33(26-38(35)51-37)44-48-42(30-11-5-2-6-12-30)47-43(49-44)31-13-7-3-8-14-31;44-30-19-15-25(16-20-30)37-39-38(32-13-7-8-14-34(32)51-39)46-42(45-37)28-18-22-35-33(23-28)31-21-17-29(24-36(31)50-35)43-48-40(26-9-3-1-4-10-26)47-41(49-43)27-11-5-2-6-12-27;1-4-12-26(13-5-1)37-39-38(32-18-10-11-19-34(32)49-39)45-42(44-37)29-21-23-35-33(24-29)31-22-20-30(25-36(31)50-35)43-47-40(27-14-6-2-7-15-27)46-41(48-43)28-16-8-3-9-17-28/h1-29H;2-27H,1H3;1-24H;1-25H.
What are the key properties of 2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-(4-fluorophenyl)-[1]benzothiolo[3,2-d]pyrimidine;2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-phenyl-[1]benzofuro[3,2-d]pyrimidine;2-[3-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-[4-(4-methylphenyl)-5-phenylsulfanylpyrimidin-2-yl]dibenzothiophen-3-yl]-4,6-diphenyl-1,3,5-triazine?
2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-(4-fluorophenyl)-[1]benzothiolo[3,2-d]pyrimidine;2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-phenyl-[1]benzofuro[3,2-d]pyrimidine;2-[3-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-[4-(4-methylphenyl)-5-phenylsulfanylpyrimidin-2-yl]dibenzothiophen-3-yl]-4,6-diphenyl-1,3,5-triazine has a molecular weight of 2797.43 g/mol, XLogP of 48.36, 23 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-(4-fluorophenyl)-[1]benzothiolo[3,2-d]pyrimidine;2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-4-phenyl-[1]benzofuro[3,2-d]pyrimidine;2-[3-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-[4-(4-methylphenyl)-5-phenylsulfanylpyrimidin-2-yl]dibenzothiophen-3-yl]-4,6-diphenyl-1,3,5-triazine is sourced from PubChem (CID 157148745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).