1-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylindole

C35H24N4 — CID 134472380

IUPAC1-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylindole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-n3cc(-c4ccccc4)c4ccccc43)n2)cc1
InChIInChI=1S/C35H24N4/c1-4-14-25(15-5-1)30-24-39(31-22-12-10-20-28(30)31)32-23-13-11-21-29(32)35-37-33(26-16-6-2-7-17-26)36-34(38-35)27-18-8-3-9-19-27/h1-24H
InChIKeySSJCMLADDAPFRS-UHFFFAOYSA-N
MW500.61 g/mol
LogP8.48
Rot. Bonds5

About 1-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylindole

1-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylindole (PubChem CID 134472380) has the molecular formula C35H24N4 and a molecular weight of 500.61 g/mol. Its IUPAC name is 1-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylindole.

Molecular Properties

Compound Name1-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylindole
PubChem CID134472380
Molecular FormulaC35H24N4
Molecular Weight500.61 g/mol
Exact Mass500.20
IUPAC Name1-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylindole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-n3cc(-c4ccccc4)c4ccccc43)n2)cc1
InChIInChI=1S/C35H24N4/c1-4-14-25(15-5-1)30-24-39(31-22-12-10-20-28(30)31)32-23-13-11-21-29(32)35-37-33(26-16-6-2-7-17-26)36-34(38-35)27-18-8-3-9-19-27/h1-24H
InChIKeySSJCMLADDAPFRS-UHFFFAOYSA-N
XLogP8.48
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500500.61
LogP ≤ 58.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

boranuide;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 158893462
9-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazole
CID 167032295
9-[2-carbazol-9-yl-3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 121401452
11-phenyl-12-[2-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]indolo[2,3-a]carbazole
CID 169014688
9-[4-carbazol-9-yl-2,5-bis(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 146472254
9-[4-(2-carbazol-9-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-4-phenylcarbazole
CID 170669730
9-[4-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 23527808
9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,5-diphenylphenyl]carbazole
CID 140903092
2,4-diphenyl-6-[2-(2-phenylimidazol-1-yl)phenyl]-1,3,5-triazine
CID 176879151
5-[2-[4-(2-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole
CID 146573174
11-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-phenylindolo[3,2-b]carbazole;ethane
CID 144644723
9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4-phenylphenyl)pyrido[2,3-b]indole
CID 176750363

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylindole?
The IUPAC name of 1-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylindole (CID 134472380) is 1-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylindole.
What is the SMILES notation for 1-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylindole?
The canonical SMILES for 1-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylindole is c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-n3cc(-c4ccccc4)c4ccccc43)n2)cc1.
What is the InChIKey of 1-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylindole?
The InChIKey is SSJCMLADDAPFRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H24N4/c1-4-14-25(15-5-1)30-24-39(31-22-12-10-20-28(30)31)32-23-13-11-21-29(32)35-37-33(26-16-6-2-7-17-26)36-34(38-35)27-18-8-3-9-19-27/h1-24H.
What are the key properties of 1-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylindole?
1-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylindole has a molecular weight of 500.61 g/mol, XLogP of 8.48, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylindole is sourced from PubChem (CID 134472380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).