9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2,4-dimethylphenyl)-7-[2-methyl-4-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[4-methyl-2-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[2-methyl-4-(trifluoromethyl)phenyl]carbazole

C167H107F9N12S3 — CID 158941934

IUPAC9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2,4-dimethylphenyl)-7-[2-methyl-4-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[4-methyl-2-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[2-methyl-4-(trifluoromethyl)phenyl]carbazole
SMILESCc1cc(C(F)(F)F)ccc1-c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2cccc3sc4ccccc4c23)cc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1ccc(-c2ccc3c4ccc(-c5ccc(C(F)(F)F)cc5C)cc4n(-c4ccc(-c5cccc6sc7ccccc7c56)cc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3c2)c(C)c1.Cc1ccc(-c2ccc3c4ccccc4n(-c4ccc(-c5cccc6sc7ccccc7c56)cc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3c2)c(C(F)(F)F)c1
InChIInChI=1S/C61H41F3N4S.2C53H33F3N4S/c1-36-21-26-45(37(2)31-36)42-22-27-48-49-28-23-43(46-29-25-44(32-38(46)3)61(62,63)64)35-54(49)68(53(48)34-42)52-30-24-41(47-18-12-20-56-57(47)50-17-10-11-19-55(50)69-56)33-51(52)60-66-58(39-13-6-4-7-14-39)65-59(67-60)40-15-8-5-9-16-40;1-32-29-37(53(54,55)56)25-26-38(32)35-23-27-45-42(30-35)40-17-8-10-20-44(40)60(45)46-28-24-36(39-19-12-22-48-49(39)41-18-9-11-21-47(41)61-48)31-43(46)52-58-50(33-13-4-2-5-14-33)57-51(59-52)34-15-6-3-7-16-34;1-32-23-26-37(43(29-32)53(54,55)56)36-24-27-40-39-17-8-10-20-44(39)60(46(40)31-36)45-28-25-35(38-19-12-22-48-49(38)41-18-9-11-21-47(41)61-48)30-42(45)52-58-50(33-13-4-2-5-14-33)57-51(59-52)34-15-6-3-7-16-34/h4-35H,1-3H3;2*2-31H,1H3
InChIKeyJKIZEAGVPKEOCJ-UHFFFAOYSA-N
MW2548.96 g/mol
LogP47.28
Rot. Bonds19

About 9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2,4-dimethylphenyl)-7-[2-methyl-4-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[4-methyl-2-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[2-methyl-4-(trifluoromethyl)phenyl]carbazole

9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2,4-dimethylphenyl)-7-[2-methyl-4-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[4-methyl-2-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[2-methyl-4-(trifluoromethyl)phenyl]carbazole (PubChem CID 158941934) has the molecular formula C167H107F9N12S3 and a molecular weight of 2548.96 g/mol. Its IUPAC name is 9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2,4-dimethylphenyl)-7-[2-methyl-4-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[4-methyl-2-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[2-methyl-4-(trifluoromethyl)phenyl]carbazole.

Molecular Properties

Compound Name9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2,4-dimethylphenyl)-7-[2-methyl-4-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[4-methyl-2-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[2-methyl-4-(trifluoromethyl)phenyl]carbazole
PubChem CID158941934
Molecular FormulaC167H107F9N12S3
Molecular Weight2548.96 g/mol
Exact Mass2546.78
IUPAC Name9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2,4-dimethylphenyl)-7-[2-methyl-4-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[4-methyl-2-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[2-methyl-4-(trifluoromethyl)phenyl]carbazole
SMILESCc1cc(C(F)(F)F)ccc1-c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2cccc3sc4ccccc4c23)cc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1ccc(-c2ccc3c4ccc(-c5ccc(C(F)(F)F)cc5C)cc4n(-c4ccc(-c5cccc6sc7ccccc7c56)cc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3c2)c(C)c1.Cc1ccc(-c2ccc3c4ccccc4n(-c4ccc(-c5cccc6sc7ccccc7c56)cc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3c2)c(C(F)(F)F)c1
InChIInChI=1S/C61H41F3N4S.2C53H33F3N4S/c1-36-21-26-45(37(2)31-36)42-22-27-48-49-28-23-43(46-29-25-44(32-38(46)3)61(62,63)64)35-54(49)68(53(48)34-42)52-30-24-41(47-18-12-20-56-57(47)50-17-10-11-19-55(50)69-56)33-51(52)60-66-58(39-13-6-4-7-14-39)65-59(67-60)40-15-8-5-9-16-40;1-32-29-37(53(54,55)56)25-26-38(32)35-23-27-45-42(30-35)40-17-8-10-20-44(40)60(45)46-28-24-36(39-19-12-22-48-49(39)41-18-9-11-21-47(41)61-48)31-43(46)52-58-50(33-13-4-2-5-14-33)57-51(59-52)34-15-6-3-7-16-34;1-32-23-26-37(43(29-32)53(54,55)56)36-24-27-40-39-17-8-10-20-44(39)60(46(40)31-36)45-28-25-35(38-19-12-22-48-49(38)41-18-9-11-21-47(41)61-48)30-42(45)52-58-50(33-13-4-2-5-14-33)57-51(59-52)34-15-6-3-7-16-34/h4-35H,1-3H3;2*2-31H,1H3
InChIKeyJKIZEAGVPKEOCJ-UHFFFAOYSA-N
XLogP47.28
TPSA130.80 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds19
Heavy Atoms191
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002548.96
LogP ≤ 547.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2,4-dimethylphenyl)-7-[2-methyl-4-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[4-methyl-2-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[2-methyl-4-(trifluoromethyl)phenyl]carbazole with MolForge

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Related Compounds

7,18-Bis(1,1,2,2,3,3,3-heptafluoropropyl)-10,15,21,25-tetrakis(3-methylthiophen-2-yl)-6,8,17,19-tetrazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(22),2(26),3,5(25),6,8,10,12,14,16,18,20,23-tridecaene
CID 139095708
7,18-Bis(1,1,2,2,3,3,3-heptafluoropropyl)-10,15,21,25-tetrakis(3-hexylthiophen-2-yl)-6,8,17,19-tetrazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(22),2(26),3,5(25),6,8,10,12,14,16,18,20,23-tridecaene
CID 139095710
9-[4-[4,6-Bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]-35-phenyl-18-thia-9,35-diazanonacyclo[18.15.0.02,10.03,8.011,19.012,17.021,34.022,27.028,33]pentatriaconta-1(20),2(10),3,5,7,11(19),12,14,16,21(34),22,24,26,28,30,32-hexadecaene
CID 117725981
9-[4-[4,6-Bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]-35-phenyl-12-thia-9,35-diazanonacyclo[18.15.0.02,10.03,8.011,19.013,18.021,34.022,27.028,33]pentatriaconta-1,3,5,7,10,13,15,17,19,21(34),22,24,26,28,30,32-hexadecaene
CID 118634449
3-[9-[6-(8-Fluorodibenzothiophen-2-yl)-2-pyridinyl]carbazol-2-yl]-9-phenylcarbazole
CID 121276719
3-[9-[4-(8-Fluorodibenzothiophen-2-yl)-6-phenyl-1,3,5-triazin-2-yl]carbazol-2-yl]-9-phenylcarbazole
CID 121276722
3-[9-[4,6-Bis(8-fluorodibenzothiophen-2-yl)-1,3,5-triazin-2-yl]carbazol-3-yl]-9-phenylcarbazole
CID 121276727
3-[9-[4-(8-Fluorodibenzothiophen-2-yl)-6-phenylpyrimidin-2-yl]carbazol-2-yl]-9-phenylcarbazole
CID 121276730
3-[9-[4,6-Bis(8-fluorodibenzothiophen-2-yl)-1,3,5-triazin-2-yl]carbazol-2-yl]-9-phenylcarbazole
CID 121276732
3-[9-[4,6-Bis(8-fluorodibenzothiophen-2-yl)pyrimidin-2-yl]carbazol-2-yl]-9-phenylcarbazole
CID 121276733
3-[9-[4,6-Bis(8-fluorodibenzothiophen-2-yl)pyrimidin-2-yl]carbazol-3-yl]-9-phenylcarbazole
CID 121276737
3-[9-[4,6-Bis(6-fluorodibenzothiophen-4-yl)pyrimidin-2-yl]carbazol-2-yl]-9-phenylcarbazole
CID 121276738

Frequently Asked Questions

What is the IUPAC name of 9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2,4-dimethylphenyl)-7-[2-methyl-4-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[4-methyl-2-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[2-methyl-4-(trifluoromethyl)phenyl]carbazole?
The IUPAC name of 9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2,4-dimethylphenyl)-7-[2-methyl-4-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[4-methyl-2-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[2-methyl-4-(trifluoromethyl)phenyl]carbazole (CID 158941934) is 9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2,4-dimethylphenyl)-7-[2-methyl-4-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[4-methyl-2-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[2-methyl-4-(trifluoromethyl)phenyl]carbazole.
What is the SMILES notation for 9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2,4-dimethylphenyl)-7-[2-methyl-4-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[4-methyl-2-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[2-methyl-4-(trifluoromethyl)phenyl]carbazole?
The canonical SMILES for 9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2,4-dimethylphenyl)-7-[2-methyl-4-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[4-methyl-2-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[2-methyl-4-(trifluoromethyl)phenyl]carbazole is Cc1cc(C(F)(F)F)ccc1-c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2cccc3sc4ccccc4c23)cc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1ccc(-c2ccc3c4ccc(-c5ccc(C(F)(F)F)cc5C)cc4n(-c4ccc(-c5cccc6sc7ccccc7c56)cc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3c2)c(C)c1.Cc1ccc(-c2ccc3c4ccccc4n(-c4ccc(-c5cccc6sc7ccccc7c56)cc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3c2)c(C(F)(F)F)c1.
What is the InChIKey of 9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2,4-dimethylphenyl)-7-[2-methyl-4-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[4-methyl-2-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[2-methyl-4-(trifluoromethyl)phenyl]carbazole?
The InChIKey is JKIZEAGVPKEOCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H41F3N4S.2C53H33F3N4S/c1-36-21-26-45(37(2)31-36)42-22-27-48-49-28-23-43(46-29-25-44(32-38(46)3)61(62,63)64)35-54(49)68(53(48)34-42)52-30-24-41(47-18-12-20-56-57(47)50-17-10-11-19-55(50)69-56)33-51(52)60-66-58(39-13-6-4-7-14-39)65-59(67-60)40-15-8-5-9-16-40;1-32-29-37(53(54,55)56)25-26-38(32)35-23-27-45-42(30-35)40-17-8-10-20-44(40)60(45)46-28-24-36(39-19-12-22-48-49(39)41-18-9-11-21-47(41)61-48)31-43(46)52-58-50(33-13-4-2-5-14-33)57-51(59-52)34-15-6-3-7-16-34;1-32-23-26-37(43(29-32)53(54,55)56)36-24-27-40-39-17-8-10-20-44(39)60(46(40)31-36)45-28-25-35(38-19-12-22-48-49(38)41-18-9-11-21-47(41)61-48)30-42(45)52-58-50(33-13-4-2-5-14-33)57-51(59-52)34-15-6-3-7-16-34/h4-35H,1-3H3;2*2-31H,1H3.
What are the key properties of 9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2,4-dimethylphenyl)-7-[2-methyl-4-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[4-methyl-2-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[2-methyl-4-(trifluoromethyl)phenyl]carbazole?
9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2,4-dimethylphenyl)-7-[2-methyl-4-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[4-methyl-2-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[2-methyl-4-(trifluoromethyl)phenyl]carbazole has a molecular weight of 2548.96 g/mol, XLogP of 47.28, 19 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2,4-dimethylphenyl)-7-[2-methyl-4-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[4-methyl-2-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[2-methyl-4-(trifluoromethyl)phenyl]carbazole is sourced from PubChem (CID 158941934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).