9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-methyl-6-(trifluoromethyl)carbazole

C151H97F3N12O3 — CID 159203969

IUPAC9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-methyl-6-(trifluoromethyl)carbazole
SMILESCc1ccc2c(c1)c1cc(C(F)(F)F)ccc1n2-c1ccc(-c2ccc3c(c2)oc2ccccc23)cc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1ccccc1-c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc3c(c2)oc2ccccc23)cc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1ccccc1-c1ccc2c3ccccc3n(-c3ccc(-c4ccc5c(c4)oc4ccccc45)cc3-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2c1
InChIInChI=1S/2C52H34N4O.C47H29F3N4O/c1-33-14-8-9-19-39(33)38-25-27-41-40-20-10-12-22-45(40)56(47(41)31-38)46-29-26-36(37-24-28-43-42-21-11-13-23-48(42)57-49(43)32-37)30-44(46)52-54-50(34-15-4-2-5-16-34)53-51(55-52)35-17-6-3-7-18-35;1-33-14-8-9-19-39(33)38-26-29-46-43(31-38)40-20-10-12-22-45(40)56(46)47-28-25-36(37-24-27-42-41-21-11-13-23-48(41)57-49(42)32-37)30-44(47)52-54-50(34-15-4-2-5-16-34)53-51(55-52)35-17-6-3-7-18-35;1-28-16-21-39-36(24-28)37-27-33(47(48,49)50)19-23-40(37)54(39)41-22-18-31(32-17-20-35-34-14-8-9-15-42(34)55-43(35)26-32)25-38(41)46-52-44(29-10-4-2-5-11-29)51-45(53-46)30-12-6-3-7-13-30/h2*2-32H,1H3;2-27H,1H3
InChIKeyKPQGZPBMZFBCKI-UHFFFAOYSA-N
MW2184.51 g/mol
LogP39.89
Rot. Bonds17

About 9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-methyl-6-(trifluoromethyl)carbazole

9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-methyl-6-(trifluoromethyl)carbazole (PubChem CID 159203969) has the molecular formula C151H97F3N12O3 and a molecular weight of 2184.51 g/mol. Its IUPAC name is 9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-methyl-6-(trifluoromethyl)carbazole.

Molecular Properties

Compound Name9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-methyl-6-(trifluoromethyl)carbazole
PubChem CID159203969
Molecular FormulaC151H97F3N12O3
Molecular Weight2184.51 g/mol
Exact Mass2182.78
IUPAC Name9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-methyl-6-(trifluoromethyl)carbazole
SMILESCc1ccc2c(c1)c1cc(C(F)(F)F)ccc1n2-c1ccc(-c2ccc3c(c2)oc2ccccc23)cc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1ccccc1-c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc3c(c2)oc2ccccc23)cc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1ccccc1-c1ccc2c3ccccc3n(-c3ccc(-c4ccc5c(c4)oc4ccccc45)cc3-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2c1
InChIInChI=1S/2C52H34N4O.C47H29F3N4O/c1-33-14-8-9-19-39(33)38-25-27-41-40-20-10-12-22-45(40)56(47(41)31-38)46-29-26-36(37-24-28-43-42-21-11-13-23-48(42)57-49(43)32-37)30-44(46)52-54-50(34-15-4-2-5-16-34)53-51(55-52)35-17-6-3-7-18-35;1-33-14-8-9-19-39(33)38-26-29-46-43(31-38)40-20-10-12-22-45(40)56(46)47-28-25-36(37-24-27-42-41-21-11-13-23-48(41)57-49(42)32-37)30-44(47)52-54-50(34-15-4-2-5-16-34)53-51(55-52)35-17-6-3-7-18-35;1-28-16-21-39-36(24-28)37-27-33(47(48,49)50)19-23-40(37)54(39)41-22-18-31(32-17-20-35-34-14-8-9-15-42(34)55-43(35)26-32)25-38(41)46-52-44(29-10-4-2-5-11-29)51-45(53-46)30-12-6-3-7-13-30/h2*2-32H,1H3;2-27H,1H3
InChIKeyKPQGZPBMZFBCKI-UHFFFAOYSA-N
XLogP39.89
TPSA170.22 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds17
Heavy Atoms169
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002184.51
LogP ≤ 539.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-methyl-6-(trifluoromethyl)carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-methyl-6-(trifluoromethyl)carbazole?
The IUPAC name of 9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-methyl-6-(trifluoromethyl)carbazole (CID 159203969) is 9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-methyl-6-(trifluoromethyl)carbazole.
What is the SMILES notation for 9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-methyl-6-(trifluoromethyl)carbazole?
The canonical SMILES for 9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-methyl-6-(trifluoromethyl)carbazole is Cc1ccc2c(c1)c1cc(C(F)(F)F)ccc1n2-c1ccc(-c2ccc3c(c2)oc2ccccc23)cc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1ccccc1-c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc3c(c2)oc2ccccc23)cc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1ccccc1-c1ccc2c3ccccc3n(-c3ccc(-c4ccc5c(c4)oc4ccccc45)cc3-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2c1.
What is the InChIKey of 9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-methyl-6-(trifluoromethyl)carbazole?
The InChIKey is KPQGZPBMZFBCKI-UHFFFAOYSA-N. The full InChI is InChI=1S/2C52H34N4O.C47H29F3N4O/c1-33-14-8-9-19-39(33)38-25-27-41-40-20-10-12-22-45(40)56(47(41)31-38)46-29-26-36(37-24-28-43-42-21-11-13-23-48(42)57-49(43)32-37)30-44(46)52-54-50(34-15-4-2-5-16-34)53-51(55-52)35-17-6-3-7-18-35;1-33-14-8-9-19-39(33)38-26-29-46-43(31-38)40-20-10-12-22-45(40)56(46)47-28-25-36(37-24-27-42-41-21-11-13-23-48(41)57-49(42)32-37)30-44(47)52-54-50(34-15-4-2-5-16-34)53-51(55-52)35-17-6-3-7-18-35;1-28-16-21-39-36(24-28)37-27-33(47(48,49)50)19-23-40(37)54(39)41-22-18-31(32-17-20-35-34-14-8-9-15-42(34)55-43(35)26-32)25-38(41)46-52-44(29-10-4-2-5-11-29)51-45(53-46)30-12-6-3-7-13-30/h2*2-32H,1H3;2-27H,1H3.
What are the key properties of 9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-methyl-6-(trifluoromethyl)carbazole?
9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-methyl-6-(trifluoromethyl)carbazole has a molecular weight of 2184.51 g/mol, XLogP of 39.89, 17 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(2-methylphenyl)carbazole;9-[4-dibenzofuran-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-methyl-6-(trifluoromethyl)carbazole is sourced from PubChem (CID 159203969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).