2-(3-methylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine

C24H21N3 — CID 171058363

IUPAC2-(3-methylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine
SMILESCc1ccc(-c2nc(-c3ccc(C)cc3)nc(-c3cccc(C)c3)n2)cc1
InChIInChI=1S/C24H21N3/c1-16-7-11-19(12-8-16)22-25-23(20-13-9-17(2)10-14-20)27-24(26-22)21-6-4-5-18(3)15-21/h4-15H,1-3H3
InChIKeyFKDPWONLCZERMB-UHFFFAOYSA-N
MW351.45 g/mol
LogP5.80
Rot. Bonds3

About 2-(3-methylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine

2-(3-methylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine (PubChem CID 171058363) has the molecular formula C24H21N3 and a molecular weight of 351.45 g/mol. Its IUPAC name is 2-(3-methylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine.

Molecular Properties

Compound Name2-(3-methylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine
PubChem CID171058363
Molecular FormulaC24H21N3
Molecular Weight351.45 g/mol
Exact Mass351.17
IUPAC Name2-(3-methylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine
SMILESCc1ccc(-c2nc(-c3ccc(C)cc3)nc(-c3cccc(C)c3)n2)cc1
InChIInChI=1S/C24H21N3/c1-16-7-11-19(12-8-16)22-25-23(20-13-9-17(2)10-14-20)27-24(26-22)21-6-4-5-18(3)15-21/h4-15H,1-3H3
InChIKeyFKDPWONLCZERMB-UHFFFAOYSA-N
XLogP5.80
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.45
LogP ≤ 55.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[4-[4,6-bis(3-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 20652059
2-[3-(3-methylphenyl)phenyl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 129263613
2-(4-methylphenyl)-4,6-diphenylpyrimidine;2-(3-methylphenyl)-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4-phenyl-6-(4-phenylphenyl)pyrimidine;2-(4-methylphenyl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 162112872
2-(4-methylphenyl)-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
CID 129023213
4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine
CID 63866847
4,6-dimethyl-2-(3-methylphenyl)pyrimidine
CID 55264289
2,4-bis(3-methoxyphenyl)-6-[4-[4-[4-(3-methoxyphenyl)-6-(3-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-1,3,5-triazine
CID 20652055
2-(3,5-dibromophenyl)-4,6-bis(3-methylphenyl)-1,3,5-triazine
CID 59510678
2-(3-methylphenyl)-4-phenyl-1,3,5-triazine
CID 134408534
4-fluoro-2-(3-methylphenyl)-6-(4-methylphenyl)pyrimidine
CID 154722562
2-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]-4,6-bis(4-methylphenyl)-1,3,5-triazine
CID 59002233
2-(2-methylphenyl)-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine;2-(3-methylphenyl)-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine;2-(4-methylphenyl)-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine;2-methyl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
CID 160977966

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine?
The IUPAC name of 2-(3-methylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine (CID 171058363) is 2-(3-methylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine.
What is the SMILES notation for 2-(3-methylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine?
The canonical SMILES for 2-(3-methylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine is Cc1ccc(-c2nc(-c3ccc(C)cc3)nc(-c3cccc(C)c3)n2)cc1.
What is the InChIKey of 2-(3-methylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine?
The InChIKey is FKDPWONLCZERMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3/c1-16-7-11-19(12-8-16)22-25-23(20-13-9-17(2)10-14-20)27-24(26-22)21-6-4-5-18(3)15-21/h4-15H,1-3H3.
What are the key properties of 2-(3-methylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine?
2-(3-methylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine has a molecular weight of 351.45 g/mol, XLogP of 5.80, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine is sourced from PubChem (CID 171058363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).