4-(4-phenylphenyl)-2-[10-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-yl]quinazoline

C48H30N2O — CID 166867337

IUPAC4-(4-phenylphenyl)-2-[10-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-yl]quinazoline
SMILESc1ccc(-c2ccc(-c3cc(-c4nc(-c5ccc(-c6ccccc6)cc5)c5ccccc5n4)c4oc5ccc6ccccc6c5c4c3)cc2)cc1
InChIInChI=1S/C48H30N2O/c1-3-11-31(12-4-1)33-19-21-35(22-20-33)38-29-41-45-39-16-8-7-15-36(39)27-28-44(45)51-47(41)42(30-38)48-49-43-18-10-9-17-40(43)46(50-48)37-25-23-34(24-26-37)32-13-5-2-6-14-32/h1-30H
InChIKeyGLUJNPQGPLSEOP-UHFFFAOYSA-N
MW650.78 g/mol
LogP13.02
Rot. Bonds5

About 4-(4-phenylphenyl)-2-[10-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-yl]quinazoline

4-(4-phenylphenyl)-2-[10-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-yl]quinazoline (PubChem CID 166867337) has the molecular formula C48H30N2O and a molecular weight of 650.78 g/mol. Its IUPAC name is 4-(4-phenylphenyl)-2-[10-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-yl]quinazoline.

Molecular Properties

Compound Name4-(4-phenylphenyl)-2-[10-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-yl]quinazoline
PubChem CID166867337
Molecular FormulaC48H30N2O
Molecular Weight650.78 g/mol
Exact Mass650.24
IUPAC Name4-(4-phenylphenyl)-2-[10-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-yl]quinazoline
SMILESc1ccc(-c2ccc(-c3cc(-c4nc(-c5ccc(-c6ccccc6)cc5)c5ccccc5n4)c4oc5ccc6ccccc6c5c4c3)cc2)cc1
InChIInChI=1S/C48H30N2O/c1-3-11-31(12-4-1)33-19-21-35(22-20-33)38-29-41-45-39-16-8-7-15-36(39)27-28-44(45)51-47(41)42(30-38)48-49-43-18-10-9-17-40(43)46(50-48)37-25-23-34(24-26-37)32-13-5-2-6-14-32/h1-30H
InChIKeyGLUJNPQGPLSEOP-UHFFFAOYSA-N
XLogP13.02
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500650.78
LogP ≤ 513.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-(4-phenylphenyl)-2-[10-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-yl]quinazoline 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-[10-(3-naphthalen-1-ylphenyl)naphtho[2,1-b][1]benzofuran-8-yl]-4,6-diphenyl-1,3,5-triazine
CID 167424108
4,6-diphenyl-2-[10-(4-phenylnaphthalen-1-yl)naphtho[2,1-b][1]benzofuran-8-yl]pyrimidine
CID 167402239
2-(7-naphthalen-2-ylnaphtho[1,2-b][1]benzofuran-5-yl)-4-(4-phenylphenyl)quinazoline
CID 169049009
2-[6-(4-naphthalen-2-ylphenyl)naphtho[1,2-b][1]benzofuran-8-yl]-4-phenylquinazoline
CID 169048982
2-naphtho[2,1-b][1]benzofuran-3-yl-4-phenylquinazoline
CID 155473673
2-(4-naphthalen-2-ylphenyl)-4-(6-phenylnaphtho[1,2-b][1]benzofuran-8-yl)quinazoline
CID 169048893
2-(23-oxahexacyclo[12.7.1.13,21.02,7.08,13.018,22]tricosa-1(22),2(7),3,5,8,10,12,14,16,18,20-undecaen-20-yl)-4-phenylquinazoline
CID 139497751
2-[6,8-di(phenanthren-3-yl)dibenzofuran-1-yl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 137496724
N-[4-(4-naphtho[1,2-b][1]benzofuran-8-ylquinazolin-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 166511371
2-[6-dibenzofuran-2-yl-4-(4-phenylphenyl)dibenzofuran-1-yl]-4-phenylquinazoline
CID 156575030
13-phenyl-15-(4-phenylphenyl)-11-oxa-14,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12(17),13,15-octaene
CID 129128802
2-(19-oxapentacyclo[14.2.1.05,18.06,11.012,17]nonadeca-1,3,5(18),6,8,10,12(17),13,15-nonaen-2-yl)-4-(4-phenylphenyl)quinazoline
CID 171051285

Frequently Asked Questions

What is the IUPAC name of 4-(4-phenylphenyl)-2-[10-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-yl]quinazoline?
The IUPAC name of 4-(4-phenylphenyl)-2-[10-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-yl]quinazoline (CID 166867337) is 4-(4-phenylphenyl)-2-[10-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-yl]quinazoline.
What is the SMILES notation for 4-(4-phenylphenyl)-2-[10-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-yl]quinazoline?
The canonical SMILES for 4-(4-phenylphenyl)-2-[10-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-yl]quinazoline is c1ccc(-c2ccc(-c3cc(-c4nc(-c5ccc(-c6ccccc6)cc5)c5ccccc5n4)c4oc5ccc6ccccc6c5c4c3)cc2)cc1.
What is the InChIKey of 4-(4-phenylphenyl)-2-[10-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-yl]quinazoline?
The InChIKey is GLUJNPQGPLSEOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H30N2O/c1-3-11-31(12-4-1)33-19-21-35(22-20-33)38-29-41-45-39-16-8-7-15-36(39)27-28-44(45)51-47(41)42(30-38)48-49-43-18-10-9-17-40(43)46(50-48)37-25-23-34(24-26-37)32-13-5-2-6-14-32/h1-30H.
What are the key properties of 4-(4-phenylphenyl)-2-[10-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-yl]quinazoline?
4-(4-phenylphenyl)-2-[10-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-yl]quinazoline has a molecular weight of 650.78 g/mol, XLogP of 13.02, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-phenylphenyl)-2-[10-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-yl]quinazoline is sourced from PubChem (CID 166867337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).