2-(3,5-dimethylphenyl)-7-[3-[2-[3-[6-(3,5-dimethylphenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-methylphenyl]ethyl]-5-methylphenyl]-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazole

C112H80F6N8 — CID 138486856

IUPAC2-(3,5-dimethylphenyl)-7-[3-[2-[3-[6-(3,5-dimethylphenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-methylphenyl]ethyl]-5-methylphenyl]-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazole
SMILESCc1cc(C)cc(-c2ccc3c(c2)c2cc(-c4cc(C)cc(CCc5cc(C)cc(-c6ccc7c8ccc(-c9cc(C)cc(C)c9)cc8n(-c8cc(-c9ccccc9C(F)(F)F)ccc8-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)c7c6)c5)c4)ccc2n3-c2cc(-c3ccccc3C(F)(F)F)ccc2-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c1
InChIInChI=1S/C112H80F6N8/c1-67-49-68(2)54-85(53-67)79-41-47-99-95(61-79)96-62-80(42-48-100(96)125(99)103-65-83(89-31-19-21-33-97(89)111(113,114)115)39-45-93(103)109-121-105(75-23-11-7-12-24-75)119-106(122-109)76-25-13-8-14-26-76)87-57-71(5)51-73(59-87)35-36-74-52-72(6)58-88(60-74)82-38-44-92-91-43-37-81(86-55-69(3)50-70(4)56-86)63-101(91)126(102(92)64-82)104-66-84(90-32-20-22-34-98(90)112(116,117)118)40-46-94(104)110-123-107(77-27-15-9-16-28-77)120-108(124-110)78-29-17-10-18-30-78/h7-34,37-66H,35-36H2,1-6H3
InChIKeyUFNIYMBRLYGBRL-UHFFFAOYSA-N
MW1651.92 g/mol
LogP29.93
Rot. Bonds17

About 2-(3,5-dimethylphenyl)-7-[3-[2-[3-[6-(3,5-dimethylphenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-methylphenyl]ethyl]-5-methylphenyl]-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazole

2-(3,5-dimethylphenyl)-7-[3-[2-[3-[6-(3,5-dimethylphenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-methylphenyl]ethyl]-5-methylphenyl]-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazole (PubChem CID 138486856) has the molecular formula C112H80F6N8 and a molecular weight of 1651.92 g/mol. Its IUPAC name is 2-(3,5-dimethylphenyl)-7-[3-[2-[3-[6-(3,5-dimethylphenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-methylphenyl]ethyl]-5-methylphenyl]-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazole.

Molecular Properties

Compound Name2-(3,5-dimethylphenyl)-7-[3-[2-[3-[6-(3,5-dimethylphenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-methylphenyl]ethyl]-5-methylphenyl]-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazole
PubChem CID138486856
Molecular FormulaC112H80F6N8
Molecular Weight1651.92 g/mol
Exact Mass1650.64
IUPAC Name2-(3,5-dimethylphenyl)-7-[3-[2-[3-[6-(3,5-dimethylphenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-methylphenyl]ethyl]-5-methylphenyl]-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazole
SMILESCc1cc(C)cc(-c2ccc3c(c2)c2cc(-c4cc(C)cc(CCc5cc(C)cc(-c6ccc7c8ccc(-c9cc(C)cc(C)c9)cc8n(-c8cc(-c9ccccc9C(F)(F)F)ccc8-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)c7c6)c5)c4)ccc2n3-c2cc(-c3ccccc3C(F)(F)F)ccc2-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c1
InChIInChI=1S/C112H80F6N8/c1-67-49-68(2)54-85(53-67)79-41-47-99-95(61-79)96-62-80(42-48-100(96)125(99)103-65-83(89-31-19-21-33-97(89)111(113,114)115)39-45-93(103)109-121-105(75-23-11-7-12-24-75)119-106(122-109)76-25-13-8-14-26-76)87-57-71(5)51-73(59-87)35-36-74-52-72(6)58-88(60-74)82-38-44-92-91-43-37-81(86-55-69(3)50-70(4)56-86)63-101(91)126(102(92)64-82)104-66-84(90-32-20-22-34-98(90)112(116,117)118)40-46-94(104)110-123-107(77-27-15-9-16-28-77)120-108(124-110)78-29-17-10-18-30-78/h7-34,37-66H,35-36H2,1-6H3
InChIKeyUFNIYMBRLYGBRL-UHFFFAOYSA-N
XLogP29.93
TPSA87.20 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds17
Heavy Atoms126
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001651.92
LogP ≤ 529.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazole
CID 138486662
9-[5-[2,4-bis(trifluoromethyl)phenyl]-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(2,4,6-trimethylphenyl)carbazole
CID 162611758
9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,7-bis(3,5-dimethylphenyl)carbazole
CID 138566209
3-(3,5-dimethylphenyl)-9-[5-[3-[3-[3-(3,5-dimethylphenyl)carbazol-9-yl]-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 162500772
3-[7-(3-cyanophenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazol-2-yl]benzonitrile
CID 138486658
9-[5-[2,4-bis(trifluoromethyl)phenyl]-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole
CID 162611729
2,7-bis(3,5-dimethylphenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-(3-fluorophenyl)phenyl]carbazole
CID 138549721
9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[2-(trifluoromethyl)phenyl]phenyl]-3-phenylcarbazole
CID 142543874
9-[3-[2-[3,6-bis(3,5-dimethylphenyl)carbazol-9-yl]-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(trifluoromethyl)phenyl]-3,6-bis(3,5-dimethylphenyl)carbazole
CID 169059921
2-(2,4-dimethylphenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[4-(trifluoromethyl)phenyl]phenyl]carbazole
CID 138486639
2-[2,4-bis(trifluoromethyl)phenyl]-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[2-(trifluoromethyl)phenyl]phenyl]carbazole
CID 138486474
3,6-bis(3,5-dimethylphenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-(3-fluorophenyl)phenyl]carbazole
CID 138549722

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylphenyl)-7-[3-[2-[3-[6-(3,5-dimethylphenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-methylphenyl]ethyl]-5-methylphenyl]-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazole?
The IUPAC name of 2-(3,5-dimethylphenyl)-7-[3-[2-[3-[6-(3,5-dimethylphenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-methylphenyl]ethyl]-5-methylphenyl]-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazole (CID 138486856) is 2-(3,5-dimethylphenyl)-7-[3-[2-[3-[6-(3,5-dimethylphenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-methylphenyl]ethyl]-5-methylphenyl]-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazole.
What is the SMILES notation for 2-(3,5-dimethylphenyl)-7-[3-[2-[3-[6-(3,5-dimethylphenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-methylphenyl]ethyl]-5-methylphenyl]-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazole?
The canonical SMILES for 2-(3,5-dimethylphenyl)-7-[3-[2-[3-[6-(3,5-dimethylphenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-methylphenyl]ethyl]-5-methylphenyl]-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazole is Cc1cc(C)cc(-c2ccc3c(c2)c2cc(-c4cc(C)cc(CCc5cc(C)cc(-c6ccc7c8ccc(-c9cc(C)cc(C)c9)cc8n(-c8cc(-c9ccccc9C(F)(F)F)ccc8-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)c7c6)c5)c4)ccc2n3-c2cc(-c3ccccc3C(F)(F)F)ccc2-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c1.
What is the InChIKey of 2-(3,5-dimethylphenyl)-7-[3-[2-[3-[6-(3,5-dimethylphenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-methylphenyl]ethyl]-5-methylphenyl]-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazole?
The InChIKey is UFNIYMBRLYGBRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C112H80F6N8/c1-67-49-68(2)54-85(53-67)79-41-47-99-95(61-79)96-62-80(42-48-100(96)125(99)103-65-83(89-31-19-21-33-97(89)111(113,114)115)39-45-93(103)109-121-105(75-23-11-7-12-24-75)119-106(122-109)76-25-13-8-14-26-76)87-57-71(5)51-73(59-87)35-36-74-52-72(6)58-88(60-74)82-38-44-92-91-43-37-81(86-55-69(3)50-70(4)56-86)63-101(91)126(102(92)64-82)104-66-84(90-32-20-22-34-98(90)112(116,117)118)40-46-94(104)110-123-107(77-27-15-9-16-28-77)120-108(124-110)78-29-17-10-18-30-78/h7-34,37-66H,35-36H2,1-6H3.
What are the key properties of 2-(3,5-dimethylphenyl)-7-[3-[2-[3-[6-(3,5-dimethylphenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-methylphenyl]ethyl]-5-methylphenyl]-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazole?
2-(3,5-dimethylphenyl)-7-[3-[2-[3-[6-(3,5-dimethylphenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-methylphenyl]ethyl]-5-methylphenyl]-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazole has a molecular weight of 1651.92 g/mol, XLogP of 29.93, 17 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylphenyl)-7-[3-[2-[3-[6-(3,5-dimethylphenyl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-methylphenyl]ethyl]-5-methylphenyl]-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-(trifluoromethyl)phenyl]phenyl]carbazole is sourced from PubChem (CID 138486856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).