2,4-bis(4-tert-butylphenyl)-6-(4-ethenylphenyl)-1,3,5-triazine;9-[4-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]phenyl]-3-ethenylcarbazole;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]-3-ethenylcarbazole;3-(4-ethenylphenyl)-4-naphthalen-1-yl-5-phenyl-1,2,4-triazole

C141H118N16 — CID 161454342

IUPAC2,4-bis(4-tert-butylphenyl)-6-(4-ethenylphenyl)-1,3,5-triazine;9-[4-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]phenyl]-3-ethenylcarbazole;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]-3-ethenylcarbazole;3-(4-ethenylphenyl)-4-naphthalen-1-yl-5-phenyl-1,2,4-triazole
SMILESC=Cc1ccc(-c2nc(-c3ccc(C(C)(C)C)cc3)nc(-c3ccc(C(C)(C)C)cc3)n2)cc1.C=Cc1ccc(-c2nnc(-c3ccccc3)n2-c2cccc3ccccc23)cc1.C=Cc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2nc(-c3ccc(C(C)(C)C)cc3)nc(-c3ccc(C(C)(C)C)cc3)n2)cc1.C=Cc1ccc2c(c1)c1ccccc1n2-c1nc(-n2c3ccccc3c3ccccc32)nc(-n2c3ccccc3c3ccccc32)n1
InChIInChI=1S/C43H40N4.C41H26N6.C31H33N3.C26H19N3/c1-8-28-13-26-38-36(27-28)35-11-9-10-12-37(35)47(38)34-24-18-31(19-25-34)41-45-39(29-14-20-32(21-15-29)42(2,3)4)44-40(46-41)30-16-22-33(23-17-30)43(5,6)7;1-2-26-23-24-38-32(25-26)31-17-7-12-22-37(31)47(38)41-43-39(45-33-18-8-3-13-27(33)28-14-4-9-19-34(28)45)42-40(44-41)46-35-20-10-5-15-29(35)30-16-6-11-21-36(30)46;1-8-21-9-11-22(12-10-21)27-32-28(23-13-17-25(18-14-23)30(2,3)4)34-29(33-27)24-15-19-26(20-16-24)31(5,6)7;1-2-19-15-17-22(18-16-19)26-28-27-25(21-10-4-3-5-11-21)29(26)24-14-8-12-20-9-6-7-13-23(20)24/h8-27H,1H2,2-7H3;2-25H,1H2;8-20H,1H2,2-7H3;2-18H,1H2
InChIKeyWAYKNTRVXIPZHQ-UHFFFAOYSA-N
MW2036.61 g/mol
LogP35.52
Rot. Bonds17

About 2,4-bis(4-tert-butylphenyl)-6-(4-ethenylphenyl)-1,3,5-triazine;9-[4-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]phenyl]-3-ethenylcarbazole;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]-3-ethenylcarbazole;3-(4-ethenylphenyl)-4-naphthalen-1-yl-5-phenyl-1,2,4-triazole

2,4-bis(4-tert-butylphenyl)-6-(4-ethenylphenyl)-1,3,5-triazine;9-[4-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]phenyl]-3-ethenylcarbazole;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]-3-ethenylcarbazole;3-(4-ethenylphenyl)-4-naphthalen-1-yl-5-phenyl-1,2,4-triazole (PubChem CID 161454342) has the molecular formula C141H118N16 and a molecular weight of 2036.61 g/mol. Its IUPAC name is 2,4-bis(4-tert-butylphenyl)-6-(4-ethenylphenyl)-1,3,5-triazine;9-[4-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]phenyl]-3-ethenylcarbazole;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]-3-ethenylcarbazole;3-(4-ethenylphenyl)-4-naphthalen-1-yl-5-phenyl-1,2,4-triazole.

Molecular Properties

Compound Name2,4-bis(4-tert-butylphenyl)-6-(4-ethenylphenyl)-1,3,5-triazine;9-[4-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]phenyl]-3-ethenylcarbazole;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]-3-ethenylcarbazole;3-(4-ethenylphenyl)-4-naphthalen-1-yl-5-phenyl-1,2,4-triazole
PubChem CID161454342
Molecular FormulaC141H118N16
Molecular Weight2036.61 g/mol
Exact Mass2034.97
IUPAC Name2,4-bis(4-tert-butylphenyl)-6-(4-ethenylphenyl)-1,3,5-triazine;9-[4-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]phenyl]-3-ethenylcarbazole;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]-3-ethenylcarbazole;3-(4-ethenylphenyl)-4-naphthalen-1-yl-5-phenyl-1,2,4-triazole
SMILESC=Cc1ccc(-c2nc(-c3ccc(C(C)(C)C)cc3)nc(-c3ccc(C(C)(C)C)cc3)n2)cc1.C=Cc1ccc(-c2nnc(-c3ccccc3)n2-c2cccc3ccccc23)cc1.C=Cc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2nc(-c3ccc(C(C)(C)C)cc3)nc(-c3ccc(C(C)(C)C)cc3)n2)cc1.C=Cc1ccc2c(c1)c1ccccc1n2-c1nc(-n2c3ccccc3c3ccccc32)nc(-n2c3ccccc3c3ccccc32)n1
InChIInChI=1S/C43H40N4.C41H26N6.C31H33N3.C26H19N3/c1-8-28-13-26-38-36(27-28)35-11-9-10-12-37(35)47(38)34-24-18-31(19-25-34)41-45-39(29-14-20-32(21-15-29)42(2,3)4)44-40(46-41)30-16-22-33(23-17-30)43(5,6)7;1-2-26-23-24-38-32(25-26)31-17-7-12-22-37(31)47(38)41-43-39(45-33-18-8-3-13-27(33)28-14-4-9-19-34(28)45)42-40(44-41)46-35-20-10-5-15-29(35)30-16-6-11-21-36(30)46;1-8-21-9-11-22(12-10-21)27-32-28(23-13-17-25(18-14-23)30(2,3)4)34-29(33-27)24-15-19-26(20-16-24)31(5,6)7;1-2-19-15-17-22(18-16-19)26-28-27-25(21-10-4-3-5-11-21)29(26)24-14-8-12-20-9-6-7-13-23(20)24/h8-27H,1H2,2-7H3;2-25H,1H2;8-20H,1H2,2-7H3;2-18H,1H2
InChIKeyWAYKNTRVXIPZHQ-UHFFFAOYSA-N
XLogP35.52
TPSA166.44 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds17
Heavy Atoms157
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002036.61
LogP ≤ 535.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 2,4-bis(4-tert-butylphenyl)-6-(4-ethenylphenyl)-1,3,5-triazine;9-[4-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]phenyl]-3-ethenylcarbazole;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]-3-ethenylcarbazole;3-(4-ethenylphenyl)-4-naphthalen-1-yl-5-phenyl-1,2,4-triazole with MolForge

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Related Compounds

bis(2,6-dimethylphenyl)-(4-ethenyl-2,6-dimethylphenyl)borane;3-(4-tert-butylphenyl)-5-[4-(4-ethenylphenyl)phenyl]-4-phenyl-1,2,4-triazole;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]-3-ethenylcarbazole;3-(4-ethenylphenyl)-4-naphthalen-1-yl-5-phenyl-1,2,4-triazole
CID 159838024
9-[4-(4-tert-butylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-3-carbazol-9-ylcarbazole
CID 118053607
5-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-7-phenylindolo[2,3-b]carbazole
CID 118504560
3-(9-tert-butylcarbazol-3-yl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;2-[9-(4-tert-butylphenyl)carbazol-3-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-methyl-7-(9-phenylcarbazol-3-yl)carbazole
CID 158368353
3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole
CID 146573165
3-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole
CID 146573156
9-[3-[9-(4-tert-butylphenyl)carbazol-3-yl]-5-[9-(4-ethenylphenyl)carbazol-3-yl]phenyl]-3-naphthalen-2-yl-6-phenylcarbazole
CID 122472162
11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-naphthalen-1-ylindolo[3,2-b]carbazole
CID 138623405
5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,7-diphenylindolo[2,3-b]carbazole;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-phenyl-2-tritylindolo[2,3-b]carbazole
CID 162187881
9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,6-bis[9-(4-methylphenyl)carbazol-3-yl]carbazole
CID 58556534
3-[9-(4-phenylphenyl)carbazol-3-yl]-9-[4-phenyl-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]carbazole
CID 162483719
3,9-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-6-(9-phenylcarbazol-2-yl)carbazole
CID 122431757

Frequently Asked Questions

What is the IUPAC name of 2,4-bis(4-tert-butylphenyl)-6-(4-ethenylphenyl)-1,3,5-triazine;9-[4-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]phenyl]-3-ethenylcarbazole;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]-3-ethenylcarbazole;3-(4-ethenylphenyl)-4-naphthalen-1-yl-5-phenyl-1,2,4-triazole?
The IUPAC name of 2,4-bis(4-tert-butylphenyl)-6-(4-ethenylphenyl)-1,3,5-triazine;9-[4-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]phenyl]-3-ethenylcarbazole;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]-3-ethenylcarbazole;3-(4-ethenylphenyl)-4-naphthalen-1-yl-5-phenyl-1,2,4-triazole (CID 161454342) is 2,4-bis(4-tert-butylphenyl)-6-(4-ethenylphenyl)-1,3,5-triazine;9-[4-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]phenyl]-3-ethenylcarbazole;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]-3-ethenylcarbazole;3-(4-ethenylphenyl)-4-naphthalen-1-yl-5-phenyl-1,2,4-triazole.
What is the SMILES notation for 2,4-bis(4-tert-butylphenyl)-6-(4-ethenylphenyl)-1,3,5-triazine;9-[4-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]phenyl]-3-ethenylcarbazole;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]-3-ethenylcarbazole;3-(4-ethenylphenyl)-4-naphthalen-1-yl-5-phenyl-1,2,4-triazole?
The canonical SMILES for 2,4-bis(4-tert-butylphenyl)-6-(4-ethenylphenyl)-1,3,5-triazine;9-[4-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]phenyl]-3-ethenylcarbazole;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]-3-ethenylcarbazole;3-(4-ethenylphenyl)-4-naphthalen-1-yl-5-phenyl-1,2,4-triazole is C=Cc1ccc(-c2nc(-c3ccc(C(C)(C)C)cc3)nc(-c3ccc(C(C)(C)C)cc3)n2)cc1.C=Cc1ccc(-c2nnc(-c3ccccc3)n2-c2cccc3ccccc23)cc1.C=Cc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2nc(-c3ccc(C(C)(C)C)cc3)nc(-c3ccc(C(C)(C)C)cc3)n2)cc1.C=Cc1ccc2c(c1)c1ccccc1n2-c1nc(-n2c3ccccc3c3ccccc32)nc(-n2c3ccccc3c3ccccc32)n1.
What is the InChIKey of 2,4-bis(4-tert-butylphenyl)-6-(4-ethenylphenyl)-1,3,5-triazine;9-[4-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]phenyl]-3-ethenylcarbazole;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]-3-ethenylcarbazole;3-(4-ethenylphenyl)-4-naphthalen-1-yl-5-phenyl-1,2,4-triazole?
The InChIKey is WAYKNTRVXIPZHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H40N4.C41H26N6.C31H33N3.C26H19N3/c1-8-28-13-26-38-36(27-28)35-11-9-10-12-37(35)47(38)34-24-18-31(19-25-34)41-45-39(29-14-20-32(21-15-29)42(2,3)4)44-40(46-41)30-16-22-33(23-17-30)43(5,6)7;1-2-26-23-24-38-32(25-26)31-17-7-12-22-37(31)47(38)41-43-39(45-33-18-8-3-13-27(33)28-14-4-9-19-34(28)45)42-40(44-41)46-35-20-10-5-15-29(35)30-16-6-11-21-36(30)46;1-8-21-9-11-22(12-10-21)27-32-28(23-13-17-25(18-14-23)30(2,3)4)34-29(33-27)24-15-19-26(20-16-24)31(5,6)7;1-2-19-15-17-22(18-16-19)26-28-27-25(21-10-4-3-5-11-21)29(26)24-14-8-12-20-9-6-7-13-23(20)24/h8-27H,1H2,2-7H3;2-25H,1H2;8-20H,1H2,2-7H3;2-18H,1H2.
What are the key properties of 2,4-bis(4-tert-butylphenyl)-6-(4-ethenylphenyl)-1,3,5-triazine;9-[4-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]phenyl]-3-ethenylcarbazole;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]-3-ethenylcarbazole;3-(4-ethenylphenyl)-4-naphthalen-1-yl-5-phenyl-1,2,4-triazole?
2,4-bis(4-tert-butylphenyl)-6-(4-ethenylphenyl)-1,3,5-triazine;9-[4-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]phenyl]-3-ethenylcarbazole;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]-3-ethenylcarbazole;3-(4-ethenylphenyl)-4-naphthalen-1-yl-5-phenyl-1,2,4-triazole has a molecular weight of 2036.61 g/mol, XLogP of 35.52, 17 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-bis(4-tert-butylphenyl)-6-(4-ethenylphenyl)-1,3,5-triazine;9-[4-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]phenyl]-3-ethenylcarbazole;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]-3-ethenylcarbazole;3-(4-ethenylphenyl)-4-naphthalen-1-yl-5-phenyl-1,2,4-triazole is sourced from PubChem (CID 161454342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).