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

C183H114F18N12S3 — CID 159803701

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

2-[3,5-bis(trifluoromethyl)phenyl]-9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-(3,5-dimethylphenyl)carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[2-methyl-4-(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazole (PubChem CID 159803701) has the molecular formula C183H114F18N12S3 and a molecular weight of 2919.17 g/mol. Its IUPAC name is 2-[3,5-bis(trifluoromethyl)phenyl]-9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-(3,5-dimethylphenyl)carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[2-methyl-4-(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazole.

Molecular Properties

• Compound Name: 2-[3,5-bis(trifluoromethyl)phenyl]-9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-(3,5-dimethylphenyl)carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[2-methyl-4-(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazole
• PubChem CID: 159803701
• Molecular Formula: C183H114F18N12S3
• Molecular Weight: 2919.17 g/mol
• Exact Mass: 2916.82
• IUPAC Name: 2-[3,5-bis(trifluoromethyl)phenyl]-9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-(3,5-dimethylphenyl)carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[2-methyl-4-(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazole
• SMILES: Cc1cc(-c2ccc3c(c2)c2cc(-c4cc(C)cc(C(F)(F)F)c4)ccc2n3-c2ccc(-c3ccc4c(c3)sc3ccccc34)cc2-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc(C(F)(F)F)c1.Cc1cc(C)cc(-c2ccc3c4ccc(-c5cc(C(F)(F)F)cc(C(F)(F)F)c5)cc4n(-c4ccc(-c5ccc6c(c5)sc5ccccc56)cc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3c2)c1.Cc1ccc(-c2ccc3c4ccc(-c5ccc(C(F)(F)F)cc5C)cc4n(-c4ccc(-c5ccc6c(c5)sc5ccccc56)cc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3c2)c(C(F)(F)F)c1
• InChI: InChI=1S/3C61H38F6N4S/c1-35-17-23-45(51(29-35)61(65,66)67)42-20-25-47-46-24-19-41(44-27-22-43(30-36(44)2)60(62,63)64)32-53(46)71(54(47)33-42)52-28-21-39(40-18-26-49-48-15-9-10-16-55(48)72-56(49)34-40)31-50(52)59-69-57(37-11-5-3-6-12-37)68-58(70-59)38-13-7-4-8-14-38;1-35-25-43(29-45(27-35)60(62,63)64)40-19-22-52-49(31-40)50-32-41(44-26-36(2)28-46(30-44)61(65,66)67)20-23-53(50)71(52)54-24-18-39(42-17-21-48-47-15-9-10-16-55(47)72-56(48)34-42)33-51(54)59-69-57(37-11-5-3-6-12-37)68-58(70-59)38-13-7-4-8-14-38;1-35-25-36(2)27-43(26-35)40-17-21-47-48-22-18-41(44-28-45(60(62,63)64)34-46(29-44)61(65,66)67)32-54(48)71(53(47)31-40)52-24-20-39(42-19-23-50-49-15-9-10-16-55(49)72-56(50)33-42)30-51(52)59-69-57(37-11-5-3-6-12-37)68-58(70-59)38-13-7-4-8-14-38/h3*3-34H,1-2H3
• InChIKey: NKCRJCBRAYWQBD-UHFFFAOYSA-N
• XLogP: 53.98
• TPSA: 130.80 Ų
• H-Bond Acceptors: 15
• Rotatable Bonds: 21
• Heavy Atoms: 216
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2919.17
LogP ≤ 5	53.98
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	15

Frequently Asked Questions

What is the IUPAC name of 2-[3,5-bis(trifluoromethyl)phenyl]-9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-(3,5-dimethylphenyl)carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[2-methyl-4-(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazole?

The IUPAC name of 2-[3,5-bis(trifluoromethyl)phenyl]-9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-(3,5-dimethylphenyl)carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[2-methyl-4-(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazole (CID 159803701) is 2-[3,5-bis(trifluoromethyl)phenyl]-9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-(3,5-dimethylphenyl)carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[2-methyl-4-(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazole.

What is the SMILES notation for 2-[3,5-bis(trifluoromethyl)phenyl]-9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-(3,5-dimethylphenyl)carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[2-methyl-4-(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazole?

The canonical SMILES for 2-[3,5-bis(trifluoromethyl)phenyl]-9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-(3,5-dimethylphenyl)carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[2-methyl-4-(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazole is Cc1cc(-c2ccc3c(c2)c2cc(-c4cc(C)cc(C(F)(F)F)c4)ccc2n3-c2ccc(-c3ccc4c(c3)sc3ccccc34)cc2-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc(C(F)(F)F)c1.Cc1cc(C)cc(-c2ccc3c4ccc(-c5cc(C(F)(F)F)cc(C(F)(F)F)c5)cc4n(-c4ccc(-c5ccc6c(c5)sc5ccccc56)cc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3c2)c1.Cc1ccc(-c2ccc3c4ccc(-c5ccc(C(F)(F)F)cc5C)cc4n(-c4ccc(-c5ccc6c(c5)sc5ccccc56)cc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3c2)c(C(F)(F)F)c1.

What is the InChIKey of 2-[3,5-bis(trifluoromethyl)phenyl]-9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-(3,5-dimethylphenyl)carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[2-methyl-4-(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazole?

The InChIKey is NKCRJCBRAYWQBD-UHFFFAOYSA-N. The full InChI is InChI=1S/3C61H38F6N4S/c1-35-17-23-45(51(29-35)61(65,66)67)42-20-25-47-46-24-19-41(44-27-22-43(30-36(44)2)60(62,63)64)32-53(46)71(54(47)33-42)52-28-21-39(40-18-26-49-48-15-9-10-16-55(48)72-56(49)34-40)31-50(52)59-69-57(37-11-5-3-6-12-37)68-58(70-59)38-13-7-4-8-14-38;1-35-25-43(29-45(27-35)60(62,63)64)40-19-22-52-49(31-40)50-32-41(44-26-36(2)28-46(30-44)61(65,66)67)20-23-53(50)71(52)54-24-18-39(42-17-21-48-47-15-9-10-16-55(47)72-56(48)34-42)33-51(54)59-69-57(37-11-5-3-6-12-37)68-58(70-59)38-13-7-4-8-14-38;1-35-25-36(2)27-43(26-35)40-17-21-47-48-22-18-41(44-28-45(60(62,63)64)34-46(29-44)61(65,66)67)32-54(48)71(53(47)31-40)52-24-20-39(42-19-23-50-49-15-9-10-16-55(49)72-56(50)33-42)30-51(52)59-69-57(37-11-5-3-6-12-37)68-58(70-59)38-13-7-4-8-14-38/h3*3-34H,1-2H3.

What are the key properties of 2-[3,5-bis(trifluoromethyl)phenyl]-9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-(3,5-dimethylphenyl)carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[2-methyl-4-(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazole?

2-[3,5-bis(trifluoromethyl)phenyl]-9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-(3,5-dimethylphenyl)carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[2-methyl-4-(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazole has a molecular weight of 2919.17 g/mol, XLogP of 53.98, 21 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3,5-bis(trifluoromethyl)phenyl]-9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-(3,5-dimethylphenyl)carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[4-dibenzothiophen-3-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[2-methyl-4-(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazole is sourced from PubChem (CID 159803701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).