2,4-diphenyl-6-[4-[1-(4-pyridin-2-ylphenyl)cyclohexyl]phenyl]-1,3,5-triazine

C38H32N4 — CID 130392322

IUPAC2,4-diphenyl-6-[4-[1-(4-pyridin-2-ylphenyl)cyclohexyl]phenyl]-1,3,5-triazine
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(C4(c5ccc(-c6ccccn6)cc5)CCCCC4)cc3)n2)cc1
InChIInChI=1S/C38H32N4/c1-4-12-29(13-5-1)35-40-36(30-14-6-2-7-15-30)42-37(41-35)31-19-23-33(24-20-31)38(25-9-3-10-26-38)32-21-17-28(18-22-32)34-16-8-11-27-39-34/h1-2,4-8,11-24,27H,3,9-10,25-26H2
InChIKeyBQIKFTKOHSQKIV-UHFFFAOYSA-N
MW544.70 g/mol
LogP9.18
Rot. Bonds6

About 2,4-diphenyl-6-[4-[1-(4-pyridin-2-ylphenyl)cyclohexyl]phenyl]-1,3,5-triazine

2,4-diphenyl-6-[4-[1-(4-pyridin-2-ylphenyl)cyclohexyl]phenyl]-1,3,5-triazine (PubChem CID 130392322) has the molecular formula C38H32N4 and a molecular weight of 544.70 g/mol. Its IUPAC name is 2,4-diphenyl-6-[4-[1-(4-pyridin-2-ylphenyl)cyclohexyl]phenyl]-1,3,5-triazine.

Molecular Properties

Compound Name2,4-diphenyl-6-[4-[1-(4-pyridin-2-ylphenyl)cyclohexyl]phenyl]-1,3,5-triazine
PubChem CID130392322
Molecular FormulaC38H32N4
Molecular Weight544.70 g/mol
Exact Mass544.26
IUPAC Name2,4-diphenyl-6-[4-[1-(4-pyridin-2-ylphenyl)cyclohexyl]phenyl]-1,3,5-triazine
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(C4(c5ccc(-c6ccccn6)cc5)CCCCC4)cc3)n2)cc1
InChIInChI=1S/C38H32N4/c1-4-12-29(13-5-1)35-40-36(30-14-6-2-7-15-30)42-37(41-35)31-19-23-33(24-20-31)38(25-9-3-10-26-38)32-21-17-28(18-22-32)34-16-8-11-27-39-34/h1-2,4-8,11-24,27H,3,9-10,25-26H2
InChIKeyBQIKFTKOHSQKIV-UHFFFAOYSA-N
XLogP9.18
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500544.70
LogP ≤ 59.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2,4-diphenyl-6-[4-[1-(4-pyridin-2-ylphenyl)cyclohexyl]phenyl]-1,3,5-triazine 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

4,6-diphenyl-2-[4-[1-(4-pyridin-2-ylphenyl)cyclohexyl]phenyl]pyrimidine
CID 121315538
2-naphthalen-1-yl-4-phenyl-6-[4-[1-(4-pyridin-2-ylphenyl)cyclohexyl]phenyl]-1,3,5-triazine
CID 121315437
2,4-diphenyl-6-[4-[1-[4-(3-phenylphenyl)phenyl]cyclohexyl]phenyl]-1,3,5-triazine
CID 121315417
2-naphthalen-2-yl-4-[4-[1-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]cyclohexyl]phenyl]-6-phenyl-1,3,5-triazine
CID 130392354
8-[4-[1-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]cyclohexyl]phenyl]quinoline
CID 130392474
8-[4-[1-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]cyclohexyl]phenyl]quinoline
CID 121315569
2-naphthalen-2-yl-4-phenyl-6-[4-[1-(4-phenylphenyl)cyclohexyl]phenyl]-1,3,5-triazine
CID 121315528
4-[4-[1-(4-naphthalen-2-ylphenyl)cyclohexyl]phenyl]-2,6-diphenylpyrimidine
CID 121315574
2-[3-[3-[3-[4-(1-phenylcyclopropyl)phenyl]phenyl]phenyl]phenyl]pyridine
CID 163572145
2,4-diphenyl-6-[3-phenyl-5-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine
CID 59510699
2-phenyl-4-[4-[1-[4-(4-phenyl-6-thiophen-2-yl-1,3,5-triazin-2-yl)phenyl]cyclohexyl]phenyl]-6-thiophen-2-yl-1,3,5-triazine
CID 121315563
2-(3,5-dipyridin-2-ylphenyl)-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine
CID 118582359

Frequently Asked Questions

What is the IUPAC name of 2,4-diphenyl-6-[4-[1-(4-pyridin-2-ylphenyl)cyclohexyl]phenyl]-1,3,5-triazine?
The IUPAC name of 2,4-diphenyl-6-[4-[1-(4-pyridin-2-ylphenyl)cyclohexyl]phenyl]-1,3,5-triazine (CID 130392322) is 2,4-diphenyl-6-[4-[1-(4-pyridin-2-ylphenyl)cyclohexyl]phenyl]-1,3,5-triazine.
What is the SMILES notation for 2,4-diphenyl-6-[4-[1-(4-pyridin-2-ylphenyl)cyclohexyl]phenyl]-1,3,5-triazine?
The canonical SMILES for 2,4-diphenyl-6-[4-[1-(4-pyridin-2-ylphenyl)cyclohexyl]phenyl]-1,3,5-triazine is c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(C4(c5ccc(-c6ccccn6)cc5)CCCCC4)cc3)n2)cc1.
What is the InChIKey of 2,4-diphenyl-6-[4-[1-(4-pyridin-2-ylphenyl)cyclohexyl]phenyl]-1,3,5-triazine?
The InChIKey is BQIKFTKOHSQKIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H32N4/c1-4-12-29(13-5-1)35-40-36(30-14-6-2-7-15-30)42-37(41-35)31-19-23-33(24-20-31)38(25-9-3-10-26-38)32-21-17-28(18-22-32)34-16-8-11-27-39-34/h1-2,4-8,11-24,27H,3,9-10,25-26H2.
What are the key properties of 2,4-diphenyl-6-[4-[1-(4-pyridin-2-ylphenyl)cyclohexyl]phenyl]-1,3,5-triazine?
2,4-diphenyl-6-[4-[1-(4-pyridin-2-ylphenyl)cyclohexyl]phenyl]-1,3,5-triazine has a molecular weight of 544.70 g/mol, XLogP of 9.18, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diphenyl-6-[4-[1-(4-pyridin-2-ylphenyl)cyclohexyl]phenyl]-1,3,5-triazine is sourced from PubChem (CID 130392322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).