1-(9,9-dimethyl-6-phenylfluoren-3-yl)-3-(2-phenylphenyl)-2-benzofuran;3,9-diphenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]carbazole;1-(8-phenyldibenzothiophen-2-yl)-3-(2-phenylphenyl)-2-benzofuran;2-phenyl-8-[3-(2-phenylphenyl)-2-benzofuran-1-yl]dibenzofuran;2-phenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]-1,3,5-triazine

C190H126N4O6S — CID 158904176

IUPAC1-(9,9-dimethyl-6-phenylfluoren-3-yl)-3-(2-phenylphenyl)-2-benzofuran;3,9-diphenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]carbazole;1-(8-phenyldibenzothiophen-2-yl)-3-(2-phenylphenyl)-2-benzofuran;2-phenyl-8-[3-(2-phenylphenyl)-2-benzofuran-1-yl]dibenzofuran;2-phenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]-1,3,5-triazine
SMILESCC1(C)c2ccc(-c3ccccc3)cc2-c2cc(-c3oc(-c4ccccc4-c4ccccc4)c4ccccc34)ccc21.c1ccc(-c2ccc3c(c2)c2cc(-c4oc(-c5ccccc5-c5ccccc5)c5ccccc45)ccc2n3-c2ccccc2)cc1.c1ccc(-c2ccc3oc4ccc(-c5oc(-c6ccccc6-c6ccccc6)c6ccccc56)cc4c3c2)cc1.c1ccc(-c2ccc3sc4ccc(-c5oc(-c6ccccc6-c6ccccc6)c6ccccc56)cc4c3c2)cc1.c1ccc(-c2ncnc(-c3oc(-c4ccccc4-c4ccccc4)c4ccccc34)n2)cc1
InChIInChI=1S/C44H29NO.C41H30O.C38H24O2.C38H24OS.C29H19N3O/c1-4-14-30(15-5-1)32-24-26-41-39(28-32)40-29-33(25-27-42(40)45(41)34-18-8-3-9-19-34)43-37-22-12-13-23-38(37)44(46-43)36-21-11-10-20-35(36)31-16-6-2-7-17-31;1-41(2)37-23-21-29(27-13-5-3-6-14-27)25-35(37)36-26-30(22-24-38(36)41)39-33-19-11-12-20-34(33)40(42-39)32-18-10-9-17-31(32)28-15-7-4-8-16-28;1-3-11-25(12-4-1)27-19-21-35-33(23-27)34-24-28(20-22-36(34)39-35)37-31-17-9-10-18-32(31)38(40-37)30-16-8-7-15-29(30)26-13-5-2-6-14-26;1-3-11-25(12-4-1)27-19-21-35-33(23-27)34-24-28(20-22-36(34)40-35)37-31-17-9-10-18-32(31)38(39-37)30-16-8-7-15-29(30)26-13-5-2-6-14-26;1-3-11-20(12-4-1)22-15-7-8-16-23(22)26-24-17-9-10-18-25(24)27(33-26)29-31-19-30-28(32-29)21-13-5-2-6-14-21/h1-29H;3-26H,1-2H3;2*1-24H;1-19H
InChIKeyJFVGEAXQLWUNEC-UHFFFAOYSA-N
MW2593.19 g/mol
LogP53.36
Rot. Bonds21

About 1-(9,9-dimethyl-6-phenylfluoren-3-yl)-3-(2-phenylphenyl)-2-benzofuran;3,9-diphenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]carbazole;1-(8-phenyldibenzothiophen-2-yl)-3-(2-phenylphenyl)-2-benzofuran;2-phenyl-8-[3-(2-phenylphenyl)-2-benzofuran-1-yl]dibenzofuran;2-phenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]-1,3,5-triazine

1-(9,9-dimethyl-6-phenylfluoren-3-yl)-3-(2-phenylphenyl)-2-benzofuran;3,9-diphenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]carbazole;1-(8-phenyldibenzothiophen-2-yl)-3-(2-phenylphenyl)-2-benzofuran;2-phenyl-8-[3-(2-phenylphenyl)-2-benzofuran-1-yl]dibenzofuran;2-phenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]-1,3,5-triazine (PubChem CID 158904176) has the molecular formula C190H126N4O6S and a molecular weight of 2593.19 g/mol. Its IUPAC name is 1-(9,9-dimethyl-6-phenylfluoren-3-yl)-3-(2-phenylphenyl)-2-benzofuran;3,9-diphenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]carbazole;1-(8-phenyldibenzothiophen-2-yl)-3-(2-phenylphenyl)-2-benzofuran;2-phenyl-8-[3-(2-phenylphenyl)-2-benzofuran-1-yl]dibenzofuran;2-phenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]-1,3,5-triazine.

Molecular Properties

Compound Name1-(9,9-dimethyl-6-phenylfluoren-3-yl)-3-(2-phenylphenyl)-2-benzofuran;3,9-diphenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]carbazole;1-(8-phenyldibenzothiophen-2-yl)-3-(2-phenylphenyl)-2-benzofuran;2-phenyl-8-[3-(2-phenylphenyl)-2-benzofuran-1-yl]dibenzofuran;2-phenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]-1,3,5-triazine
PubChem CID158904176
Molecular FormulaC190H126N4O6S
Molecular Weight2593.19 g/mol
Exact Mass2590.94
IUPAC Name1-(9,9-dimethyl-6-phenylfluoren-3-yl)-3-(2-phenylphenyl)-2-benzofuran;3,9-diphenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]carbazole;1-(8-phenyldibenzothiophen-2-yl)-3-(2-phenylphenyl)-2-benzofuran;2-phenyl-8-[3-(2-phenylphenyl)-2-benzofuran-1-yl]dibenzofuran;2-phenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]-1,3,5-triazine
SMILESCC1(C)c2ccc(-c3ccccc3)cc2-c2cc(-c3oc(-c4ccccc4-c4ccccc4)c4ccccc34)ccc21.c1ccc(-c2ccc3c(c2)c2cc(-c4oc(-c5ccccc5-c5ccccc5)c5ccccc45)ccc2n3-c2ccccc2)cc1.c1ccc(-c2ccc3oc4ccc(-c5oc(-c6ccccc6-c6ccccc6)c6ccccc56)cc4c3c2)cc1.c1ccc(-c2ccc3sc4ccc(-c5oc(-c6ccccc6-c6ccccc6)c6ccccc56)cc4c3c2)cc1.c1ccc(-c2ncnc(-c3oc(-c4ccccc4-c4ccccc4)c4ccccc34)n2)cc1
InChIInChI=1S/C44H29NO.C41H30O.C38H24O2.C38H24OS.C29H19N3O/c1-4-14-30(15-5-1)32-24-26-41-39(28-32)40-29-33(25-27-42(40)45(41)34-18-8-3-9-19-34)43-37-22-12-13-23-38(37)44(46-43)36-21-11-10-20-35(36)31-16-6-2-7-17-31;1-41(2)37-23-21-29(27-13-5-3-6-14-27)25-35(37)36-26-30(22-24-38(36)41)39-33-19-11-12-20-34(33)40(42-39)32-18-10-9-17-31(32)28-15-7-4-8-16-28;1-3-11-25(12-4-1)27-19-21-35-33(23-27)34-24-28(20-22-36(34)39-35)37-31-17-9-10-18-32(31)38(40-37)30-16-8-7-15-29(30)26-13-5-2-6-14-26;1-3-11-25(12-4-1)27-19-21-35-33(23-27)34-24-28(20-22-36(34)40-35)37-31-17-9-10-18-32(31)38(39-37)30-16-8-7-15-29(30)26-13-5-2-6-14-26;1-3-11-20(12-4-1)22-15-7-8-16-23(22)26-24-17-9-10-18-25(24)27(33-26)29-31-19-30-28(32-29)21-13-5-2-6-14-21/h1-29H;3-26H,1-2H3;2*1-24H;1-19H
InChIKeyJFVGEAXQLWUNEC-UHFFFAOYSA-N
XLogP53.36
TPSA122.44 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds21
Heavy Atoms201
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002593.19
LogP ≤ 553.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 1-(9,9-dimethyl-6-phenylfluoren-3-yl)-3-(2-phenylphenyl)-2-benzofuran;3,9-diphenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]carbazole;1-(8-phenyldibenzothiophen-2-yl)-3-(2-phenylphenyl)-2-benzofuran;2-phenyl-8-[3-(2-phenylphenyl)-2-benzofuran-1-yl]dibenzofuran;2-phenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]-1,3,5-triazine with MolForge

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Related Compounds

5-[4,6-Di(dibenzofuran-2-yl)pyrimidin-2-yl]-12-[4,6-di(dibenzothiophen-2-yl)-1,3,5-triazin-2-yl]indolo[3,2-c]carbazole
CID 88949815
5-[4-Dibenzofuran-2-yl-6-(6,7-dihydrodibenzofuran-2-yl)pyrimidin-2-yl]-12-[4,6-di(dibenzothiophen-2-yl)-1,3,5-triazin-2-yl]indolo[3,2-c]carbazole
CID 88950428
12-(4-Dibenzothiophen-2-yl-6-phenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-a]carbazole
CID 90085595
10-[9-[8-(4,6-Diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-12-phenyl-[1]benzofuro[2,3-a]carbazole
CID 90211254
3-(10,20-Dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaen-6-yl)-9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazole
CID 90211274
3-[8-[9-[6-(4,6-Diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]carbazol-3-yl]dibenzothiophen-2-yl]-9-phenylcarbazole
CID 90211351
3-(9-Dibenzofuran-4-ylcarbazol-3-yl)-9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazole
CID 90211466
12-[4,6-Di(dibenzothiophen-2-yl)-1,3,5-triazin-2-yl]-[1]benzofuro[2,3-a]carbazole
CID 117640159
9-[3,5-Bis(8-phenyldibenzothiophen-2-yl)phenyl]-14-(4-dibenzofuran-2-ylpyrimidin-2-yl)-5,18-bis(3-methylbutyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15(20),16,18-nonaene
CID 117862898
3-[8-[5-(4,6-Diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[3,2-b]carbazol-2-yl]dibenzothiophen-2-yl]-12-phenyl-[1]benzofuro[2,3-a]carbazole
CID 118503309
3-Dibenzothiophen-2-yl-6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole
CID 118507720
3-[9-[4,6-Di(dibenzothiophen-2-yl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 118507883

Frequently Asked Questions

What is the IUPAC name of 1-(9,9-dimethyl-6-phenylfluoren-3-yl)-3-(2-phenylphenyl)-2-benzofuran;3,9-diphenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]carbazole;1-(8-phenyldibenzothiophen-2-yl)-3-(2-phenylphenyl)-2-benzofuran;2-phenyl-8-[3-(2-phenylphenyl)-2-benzofuran-1-yl]dibenzofuran;2-phenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]-1,3,5-triazine?
The IUPAC name of 1-(9,9-dimethyl-6-phenylfluoren-3-yl)-3-(2-phenylphenyl)-2-benzofuran;3,9-diphenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]carbazole;1-(8-phenyldibenzothiophen-2-yl)-3-(2-phenylphenyl)-2-benzofuran;2-phenyl-8-[3-(2-phenylphenyl)-2-benzofuran-1-yl]dibenzofuran;2-phenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]-1,3,5-triazine (CID 158904176) is 1-(9,9-dimethyl-6-phenylfluoren-3-yl)-3-(2-phenylphenyl)-2-benzofuran;3,9-diphenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]carbazole;1-(8-phenyldibenzothiophen-2-yl)-3-(2-phenylphenyl)-2-benzofuran;2-phenyl-8-[3-(2-phenylphenyl)-2-benzofuran-1-yl]dibenzofuran;2-phenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]-1,3,5-triazine.
What is the SMILES notation for 1-(9,9-dimethyl-6-phenylfluoren-3-yl)-3-(2-phenylphenyl)-2-benzofuran;3,9-diphenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]carbazole;1-(8-phenyldibenzothiophen-2-yl)-3-(2-phenylphenyl)-2-benzofuran;2-phenyl-8-[3-(2-phenylphenyl)-2-benzofuran-1-yl]dibenzofuran;2-phenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]-1,3,5-triazine?
The canonical SMILES for 1-(9,9-dimethyl-6-phenylfluoren-3-yl)-3-(2-phenylphenyl)-2-benzofuran;3,9-diphenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]carbazole;1-(8-phenyldibenzothiophen-2-yl)-3-(2-phenylphenyl)-2-benzofuran;2-phenyl-8-[3-(2-phenylphenyl)-2-benzofuran-1-yl]dibenzofuran;2-phenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]-1,3,5-triazine is CC1(C)c2ccc(-c3ccccc3)cc2-c2cc(-c3oc(-c4ccccc4-c4ccccc4)c4ccccc34)ccc21.c1ccc(-c2ccc3c(c2)c2cc(-c4oc(-c5ccccc5-c5ccccc5)c5ccccc45)ccc2n3-c2ccccc2)cc1.c1ccc(-c2ccc3oc4ccc(-c5oc(-c6ccccc6-c6ccccc6)c6ccccc56)cc4c3c2)cc1.c1ccc(-c2ccc3sc4ccc(-c5oc(-c6ccccc6-c6ccccc6)c6ccccc56)cc4c3c2)cc1.c1ccc(-c2ncnc(-c3oc(-c4ccccc4-c4ccccc4)c4ccccc34)n2)cc1.
What is the InChIKey of 1-(9,9-dimethyl-6-phenylfluoren-3-yl)-3-(2-phenylphenyl)-2-benzofuran;3,9-diphenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]carbazole;1-(8-phenyldibenzothiophen-2-yl)-3-(2-phenylphenyl)-2-benzofuran;2-phenyl-8-[3-(2-phenylphenyl)-2-benzofuran-1-yl]dibenzofuran;2-phenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]-1,3,5-triazine?
The InChIKey is JFVGEAXQLWUNEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H29NO.C41H30O.C38H24O2.C38H24OS.C29H19N3O/c1-4-14-30(15-5-1)32-24-26-41-39(28-32)40-29-33(25-27-42(40)45(41)34-18-8-3-9-19-34)43-37-22-12-13-23-38(37)44(46-43)36-21-11-10-20-35(36)31-16-6-2-7-17-31;1-41(2)37-23-21-29(27-13-5-3-6-14-27)25-35(37)36-26-30(22-24-38(36)41)39-33-19-11-12-20-34(33)40(42-39)32-18-10-9-17-31(32)28-15-7-4-8-16-28;1-3-11-25(12-4-1)27-19-21-35-33(23-27)34-24-28(20-22-36(34)39-35)37-31-17-9-10-18-32(31)38(40-37)30-16-8-7-15-29(30)26-13-5-2-6-14-26;1-3-11-25(12-4-1)27-19-21-35-33(23-27)34-24-28(20-22-36(34)40-35)37-31-17-9-10-18-32(31)38(39-37)30-16-8-7-15-29(30)26-13-5-2-6-14-26;1-3-11-20(12-4-1)22-15-7-8-16-23(22)26-24-17-9-10-18-25(24)27(33-26)29-31-19-30-28(32-29)21-13-5-2-6-14-21/h1-29H;3-26H,1-2H3;2*1-24H;1-19H.
What are the key properties of 1-(9,9-dimethyl-6-phenylfluoren-3-yl)-3-(2-phenylphenyl)-2-benzofuran;3,9-diphenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]carbazole;1-(8-phenyldibenzothiophen-2-yl)-3-(2-phenylphenyl)-2-benzofuran;2-phenyl-8-[3-(2-phenylphenyl)-2-benzofuran-1-yl]dibenzofuran;2-phenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]-1,3,5-triazine?
1-(9,9-dimethyl-6-phenylfluoren-3-yl)-3-(2-phenylphenyl)-2-benzofuran;3,9-diphenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]carbazole;1-(8-phenyldibenzothiophen-2-yl)-3-(2-phenylphenyl)-2-benzofuran;2-phenyl-8-[3-(2-phenylphenyl)-2-benzofuran-1-yl]dibenzofuran;2-phenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]-1,3,5-triazine has a molecular weight of 2593.19 g/mol, XLogP of 53.36, 21 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9,9-dimethyl-6-phenylfluoren-3-yl)-3-(2-phenylphenyl)-2-benzofuran;3,9-diphenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]carbazole;1-(8-phenyldibenzothiophen-2-yl)-3-(2-phenylphenyl)-2-benzofuran;2-phenyl-8-[3-(2-phenylphenyl)-2-benzofuran-1-yl]dibenzofuran;2-phenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]-1,3,5-triazine is sourced from PubChem (CID 158904176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).