4-methyl-2-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidine

C23H16N2O — CID 130265836

IUPAC4-methyl-2-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidine
SMILESCc1nc(-c2ccc(-c3ccccc3)cc2)nc2oc3ccccc3c12
InChIInChI=1S/C23H16N2O/c1-15-21-19-9-5-6-10-20(19)26-23(21)25-22(24-15)18-13-11-17(12-14-18)16-7-3-2-4-8-16/h2-14H,1H3
InChIKeySEFFQDYFCSFJHR-UHFFFAOYSA-N
MW336.39 g/mol
LogP6.02
Rot. Bonds2

About 4-methyl-2-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidine

4-methyl-2-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidine (PubChem CID 130265836) has the molecular formula C23H16N2O and a molecular weight of 336.39 g/mol. Its IUPAC name is 4-methyl-2-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidine.

Molecular Properties

Compound Name4-methyl-2-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidine
PubChem CID130265836
Molecular FormulaC23H16N2O
Molecular Weight336.39 g/mol
Exact Mass336.13
IUPAC Name4-methyl-2-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidine
SMILESCc1nc(-c2ccc(-c3ccccc3)cc2)nc2oc3ccccc3c12
InChIInChI=1S/C23H16N2O/c1-15-21-19-9-5-6-10-20(19)26-23(21)25-22(24-15)18-13-11-17(12-14-18)16-7-3-2-4-8-16/h2-14H,1H3
InChIKeySEFFQDYFCSFJHR-UHFFFAOYSA-N
XLogP6.02
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.39
LogP ≤ 56.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-methyl-2-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidine 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-(3-phenylphenyl)-2-[4-[4-(3-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidin-2-yl]phenyl]-[1]benzofuro[2,3-d]pyrimidine;2-(4-phenylphenyl)-4-[3-[3-[4-[2-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidin-4-yl]phenyl]phenyl]phenyl]-[1]benzofuro[2,3-d]pyrimidine
CID 161158830
2-[4-[2,3-bis(ethenyl)phenyl]phenyl]-4-methyl-[1]benzofuro[2,3-d]pyrimidine
CID 145261507
11-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-[1]benzofuro[2,3-b]quinoline
CID 138661799
2-(3-phenylphenyl)-4-[4-[4-[4-(3-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidin-2-yl]phenyl]phenyl]-[1]benzofuro[2,3-d]pyrimidine
CID 122489587
2-(4-phenylphenyl)-4-[3-[3-[3-phenyl-5-[2-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidin-4-yl]phenyl]phenyl]phenyl]-[1]benzofuro[2,3-d]pyrimidine
CID 122489786
4-(4-phenylphenyl)-2-[3-[3-[4-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidin-2-yl]phenyl]phenyl]-[1]benzofuro[2,3-d]pyrimidine
CID 122489754
2-(4-phenylphenyl)-4-[2-[2-[4-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidin-2-yl]phenyl]phenyl]-[1]benzofuro[2,3-d]pyrimidine
CID 122489906
2-[3-[3-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]phenyl]phenyl]-4-phenyl-[1]benzofuro[2,3-d]pyrimidine
CID 122628772
4-[3-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]phenyl]-2-phenyl-[1]benzofuro[2,3-d]pyrimidine
CID 122628784
4-[3-[3-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]phenyl]phenyl]-2-phenyl-[1]benzofuro[2,3-d]pyrimidine
CID 122628785
2,4-di(dibenzofuran-1-yl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 138730102
2-(4-phenylphenyl)-4-[2-[4-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidin-2-yl]phenyl]-[1]benzofuro[2,3-d]pyrimidine;2-(3-phenylphenyl)-4-[2-[2-[2-(3-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidin-4-yl]phenyl]phenyl]-[1]benzofuro[2,3-d]pyrimidine;2-(3-phenylphenyl)-4-[2-[2-[2-[2-(3-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidin-4-yl]phenyl]phenyl]phenyl]-[1]benzofuro[2,3-d]pyrimidine
CID 158409214

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidine?
The IUPAC name of 4-methyl-2-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidine (CID 130265836) is 4-methyl-2-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidine.
What is the SMILES notation for 4-methyl-2-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidine?
The canonical SMILES for 4-methyl-2-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidine is Cc1nc(-c2ccc(-c3ccccc3)cc2)nc2oc3ccccc3c12.
What is the InChIKey of 4-methyl-2-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidine?
The InChIKey is SEFFQDYFCSFJHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N2O/c1-15-21-19-9-5-6-10-20(19)26-23(21)25-22(24-15)18-13-11-17(12-14-18)16-7-3-2-4-8-16/h2-14H,1H3.
What are the key properties of 4-methyl-2-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidine?
4-methyl-2-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidine has a molecular weight of 336.39 g/mol, XLogP of 6.02, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(4-phenylphenyl)-[1]benzofuro[2,3-d]pyrimidine is sourced from PubChem (CID 130265836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).