2,4-bis(4-phenylphenyl)-6-[4-(3-phenyl-2-pyridinyl)phenyl]-1,3,5-triazine

C44H30N4 — CID 156692460

IUPAC2,4-bis(4-phenylphenyl)-6-[4-(3-phenyl-2-pyridinyl)phenyl]-1,3,5-triazine
SMILESc1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc(-c5ncccc5-c5ccccc5)cc4)n3)cc2)cc1
InChIInChI=1S/C44H30N4/c1-4-11-31(12-5-1)33-18-24-37(25-19-33)42-46-43(38-26-20-34(21-27-38)32-13-6-2-7-14-32)48-44(47-42)39-28-22-36(23-29-39)41-40(17-10-30-45-41)35-15-8-3-9-16-35/h1-30H
InChIKeyXNSUBXYEKGTVHI-UHFFFAOYSA-N
MW614.75 g/mol
LogP10.94
Rot. Bonds7

About 2,4-bis(4-phenylphenyl)-6-[4-(3-phenyl-2-pyridinyl)phenyl]-1,3,5-triazine

2,4-bis(4-phenylphenyl)-6-[4-(3-phenyl-2-pyridinyl)phenyl]-1,3,5-triazine (PubChem CID 156692460) has the molecular formula C44H30N4 and a molecular weight of 614.75 g/mol. Its IUPAC name is 2,4-bis(4-phenylphenyl)-6-[4-(3-phenyl-2-pyridinyl)phenyl]-1,3,5-triazine.

Molecular Properties

Compound Name2,4-bis(4-phenylphenyl)-6-[4-(3-phenyl-2-pyridinyl)phenyl]-1,3,5-triazine
PubChem CID156692460
Molecular FormulaC44H30N4
Molecular Weight614.75 g/mol
Exact Mass614.25
IUPAC Name2,4-bis(4-phenylphenyl)-6-[4-(3-phenyl-2-pyridinyl)phenyl]-1,3,5-triazine
SMILESc1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc(-c5ncccc5-c5ccccc5)cc4)n3)cc2)cc1
InChIInChI=1S/C44H30N4/c1-4-11-31(12-5-1)33-18-24-37(25-19-33)42-46-43(38-26-20-34(21-27-38)32-13-6-2-7-14-32)48-44(47-42)39-28-22-36(23-29-39)41-40(17-10-30-45-41)35-15-8-3-9-16-35/h1-30H
InChIKeyXNSUBXYEKGTVHI-UHFFFAOYSA-N
XLogP10.94
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500614.75
LogP ≤ 510.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2,4-bis(4-phenylphenyl)-6-[4-(3-phenyl-2-pyridinyl)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

2-(4-phenylphenyl)-4-[3-phenyl-5-(2-phenyl-3-pyridinyl)phenyl]-1,3,5-triazine
CID 175213647
2-(2-phenyl-3-pyridinyl)pyrimidine
CID 58421043
2-(3-phenyl-2-pyridinyl)pyrimidine
CID 67877581
2-phenyl-3-[2-[2-(2-phenyl-3-pyridinyl)phenyl]phenyl]pyridine
CID 58947757
2,4-diphenyl-6-[2-[4-[2-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-3-pyridinyl]phenyl]phenyl]-1,3,5-triazine
CID 164817309
2-(2-chlorophenyl)-4-[4-(3-methyl-2-pyridinyl)phenyl]-6-phenyl-1,3,5-triazine
CID 163651654
2-(3-phenylphenyl)-4-(4-phenylphenyl)-6-[4-[3-(2-phenylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 171052510
3-phenyl-2-pyridin-3-ylpyridine
CID 140510629
7-[3-[3-[4-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]benzo[h]quinoline
CID 153156483
2-[4-[3-(3-methyl-2-pyridinyl)phenyl]phenyl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine
CID 146586970
7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]benzo[h]quinoline
CID 155792694
2,4-bis[4-(2-phenylphenyl)phenyl]-6-[4-(3-phenylphenyl)phenyl]-1,3,5-triazine
CID 171052493

Frequently Asked Questions

What is the IUPAC name of 2,4-bis(4-phenylphenyl)-6-[4-(3-phenyl-2-pyridinyl)phenyl]-1,3,5-triazine?
The IUPAC name of 2,4-bis(4-phenylphenyl)-6-[4-(3-phenyl-2-pyridinyl)phenyl]-1,3,5-triazine (CID 156692460) is 2,4-bis(4-phenylphenyl)-6-[4-(3-phenyl-2-pyridinyl)phenyl]-1,3,5-triazine.
What is the SMILES notation for 2,4-bis(4-phenylphenyl)-6-[4-(3-phenyl-2-pyridinyl)phenyl]-1,3,5-triazine?
The canonical SMILES for 2,4-bis(4-phenylphenyl)-6-[4-(3-phenyl-2-pyridinyl)phenyl]-1,3,5-triazine is c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc(-c5ncccc5-c5ccccc5)cc4)n3)cc2)cc1.
What is the InChIKey of 2,4-bis(4-phenylphenyl)-6-[4-(3-phenyl-2-pyridinyl)phenyl]-1,3,5-triazine?
The InChIKey is XNSUBXYEKGTVHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H30N4/c1-4-11-31(12-5-1)33-18-24-37(25-19-33)42-46-43(38-26-20-34(21-27-38)32-13-6-2-7-14-32)48-44(47-42)39-28-22-36(23-29-39)41-40(17-10-30-45-41)35-15-8-3-9-16-35/h1-30H.
What are the key properties of 2,4-bis(4-phenylphenyl)-6-[4-(3-phenyl-2-pyridinyl)phenyl]-1,3,5-triazine?
2,4-bis(4-phenylphenyl)-6-[4-(3-phenyl-2-pyridinyl)phenyl]-1,3,5-triazine has a molecular weight of 614.75 g/mol, XLogP of 10.94, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-bis(4-phenylphenyl)-6-[4-(3-phenyl-2-pyridinyl)phenyl]-1,3,5-triazine is sourced from PubChem (CID 156692460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).