4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-phenylpyrimidine

C24H20N2O — CID 71131921

IUPAC4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-phenylpyrimidine
SMILESCOc1ccc(-c2cc(-c3ccc(C)cc3)nc(-c3ccccc3)n2)cc1
InChIInChI=1S/C24H20N2O/c1-17-8-10-18(11-9-17)22-16-23(19-12-14-21(27-2)15-13-19)26-24(25-22)20-6-4-3-5-7-20/h3-16H,1-2H3
InChIKeyHOJYCMAIKAHUBF-UHFFFAOYSA-N
MW352.44 g/mol
LogP5.79
Rot. Bonds4

About 4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-phenylpyrimidine

4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-phenylpyrimidine (PubChem CID 71131921) has the molecular formula C24H20N2O and a molecular weight of 352.44 g/mol. Its IUPAC name is 4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-phenylpyrimidine.

Molecular Properties

Compound Name4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-phenylpyrimidine
PubChem CID71131921
Molecular FormulaC24H20N2O
Molecular Weight352.44 g/mol
Exact Mass352.16
IUPAC Name4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-phenylpyrimidine
SMILESCOc1ccc(-c2cc(-c3ccc(C)cc3)nc(-c3ccccc3)n2)cc1
InChIInChI=1S/C24H20N2O/c1-17-8-10-18(11-9-17)22-16-23(19-12-14-21(27-2)15-13-19)26-24(25-22)20-6-4-3-5-7-20/h3-16H,1-2H3
InChIKeyHOJYCMAIKAHUBF-UHFFFAOYSA-N
XLogP5.79
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.44
LogP ≤ 55.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-phenylpyrimidine 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

6-Ethyl-5-(4-methoxyphenyl)pyrimidine-2,4-diamine
CID 13926986
7-(2-Methoxyphenyl)quinazoline-2,4-Diamine
CID 53346505
4-Methoxy-2-(4-propoxyphenyl)quinazoline
CID 1612038
Anitrazafen
CID 44410
6-(4-Methoxyphenyl)pyrimidine-2,4-diamine
CID 2808121
6-[(Benzyloxy)methyl]-5-(4-{[(4-methoxyphenyl)methyl]amino}phenyl)pyrimidine-2,4-diamine
CID 11453509
2,4-Dicyclohexyl-6-methoxyquinazoline
CID 23640941
6-Ethyl-5-[3-(4-Methoxybiphenyl-3-Yl)prop-1-Yn-1-Yl]pyrimidine-2,4-Diamine
CID 52949513
4-(3,4-Dimethoxyphenyl)-2-hydrazino-6-phenylpyrimidine
CID 869765
N-(4,6-dimethylpyrimidin-2-yl)-N'-[2-(4-methoxyphenyl)ethyl]guanidine
CID 3013233
7-methoxy-4-methyl-N-(4-methyl-6-phenylpyrimidin-2-yl)quinazolin-2-amine
CID 1349111
4-(4-Methoxyphenyl)-6-phenylpyrimidin-2-amine
CID 12293992

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-phenylpyrimidine?
The IUPAC name of 4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-phenylpyrimidine (CID 71131921) is 4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-phenylpyrimidine.
What is the SMILES notation for 4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-phenylpyrimidine?
The canonical SMILES for 4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-phenylpyrimidine is COc1ccc(-c2cc(-c3ccc(C)cc3)nc(-c3ccccc3)n2)cc1.
What is the InChIKey of 4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-phenylpyrimidine?
The InChIKey is HOJYCMAIKAHUBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2O/c1-17-8-10-18(11-9-17)22-16-23(19-12-14-21(27-2)15-13-19)26-24(25-22)20-6-4-3-5-7-20/h3-16H,1-2H3.
What are the key properties of 4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-phenylpyrimidine?
4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-phenylpyrimidine has a molecular weight of 352.44 g/mol, XLogP of 5.79, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-phenylpyrimidine is sourced from PubChem (CID 71131921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).