2-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-3-naphthalen-1-yl-4-phenylfuro[3,2-c]quinoline

C55H35N3O — CID 164716685

IUPAC2-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-3-naphthalen-1-yl-4-phenylfuro[3,2-c]quinoline
SMILESc1ccc(-c2cc(-c3cccc(-c4cccc(-c5oc6c(c(-c7ccccc7)nc7ccccc76)c5-c5cccc6ccccc56)c4)c3)nc(-c3ccccc3)n2)cc1
InChIInChI=1S/C55H35N3O/c1-4-18-37(19-5-1)48-35-49(58-55(57-48)39-22-8-3-9-23-39)42-27-14-25-40(33-42)41-26-15-28-43(34-41)53-50(45-31-16-24-36-17-10-11-29-44(36)45)51-52(38-20-6-2-7-21-38)56-47-32-13-12-30-46(47)54(51)59-53/h1-35H
InChIKeyYZHPUSIVHZZWIY-UHFFFAOYSA-N
MW753.91 g/mol
LogP14.59
Rot. Bonds7

About 2-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-3-naphthalen-1-yl-4-phenylfuro[3,2-c]quinoline

2-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-3-naphthalen-1-yl-4-phenylfuro[3,2-c]quinoline (PubChem CID 164716685) has the molecular formula C55H35N3O and a molecular weight of 753.91 g/mol. Its IUPAC name is 2-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-3-naphthalen-1-yl-4-phenylfuro[3,2-c]quinoline.

Molecular Properties

Compound Name2-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-3-naphthalen-1-yl-4-phenylfuro[3,2-c]quinoline
PubChem CID164716685
Molecular FormulaC55H35N3O
Molecular Weight753.91 g/mol
Exact Mass753.28
IUPAC Name2-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-3-naphthalen-1-yl-4-phenylfuro[3,2-c]quinoline
SMILESc1ccc(-c2cc(-c3cccc(-c4cccc(-c5oc6c(c(-c7ccccc7)nc7ccccc76)c5-c5cccc6ccccc56)c4)c3)nc(-c3ccccc3)n2)cc1
InChIInChI=1S/C55H35N3O/c1-4-18-37(19-5-1)48-35-49(58-55(57-48)39-22-8-3-9-23-39)42-27-14-25-40(33-42)41-26-15-28-43(34-41)53-50(45-31-16-24-36-17-10-11-29-44(36)45)51-52(38-20-6-2-7-21-38)56-47-32-13-12-30-46(47)54(51)59-53/h1-35H
InChIKeyYZHPUSIVHZZWIY-UHFFFAOYSA-N
XLogP14.59
TPSA51.81 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms59
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500753.91
LogP ≤ 514.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-3-naphthalen-1-yl-4-phenylfuro[3,2-c]quinoline 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

3,4-diphenyl-2-[3-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]furo[3,2-c]quinoline
CID 164716638
3,4-diphenyl-2-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]furo[3,2-c]quinoline
CID 164716850
8-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline;8-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline;2,3,4-triphenyl-8-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]furo[3,2-c]quinoline
CID 165010573
2-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-3,4-diphenylfuro[3,2-c]quinoline
CID 164716861
1-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-2,4-diphenylfuro[2,3-c]quinoline
CID 164716416
2,4-diphenyl-1-[3-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]furo[2,3-c]quinoline
CID 164716946
2,3,4-triphenyl-8-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]furo[3,2-c]quinoline
CID 164716014
1,2-diphenyl-4-[3-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]furo[2,3-c]quinoline
CID 164716835
7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline
CID 164716190
4-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-2,6-diphenylpyrimidine
CID 145299161
2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline
CID 165077999
6-[4-[3-[2,6-bis(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]benzo[k]phenanthridine
CID 122665894

Frequently Asked Questions

What is the IUPAC name of 2-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-3-naphthalen-1-yl-4-phenylfuro[3,2-c]quinoline?
The IUPAC name of 2-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-3-naphthalen-1-yl-4-phenylfuro[3,2-c]quinoline (CID 164716685) is 2-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-3-naphthalen-1-yl-4-phenylfuro[3,2-c]quinoline.
What is the SMILES notation for 2-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-3-naphthalen-1-yl-4-phenylfuro[3,2-c]quinoline?
The canonical SMILES for 2-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-3-naphthalen-1-yl-4-phenylfuro[3,2-c]quinoline is c1ccc(-c2cc(-c3cccc(-c4cccc(-c5oc6c(c(-c7ccccc7)nc7ccccc76)c5-c5cccc6ccccc56)c4)c3)nc(-c3ccccc3)n2)cc1.
What is the InChIKey of 2-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-3-naphthalen-1-yl-4-phenylfuro[3,2-c]quinoline?
The InChIKey is YZHPUSIVHZZWIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H35N3O/c1-4-18-37(19-5-1)48-35-49(58-55(57-48)39-22-8-3-9-23-39)42-27-14-25-40(33-42)41-26-15-28-43(34-41)53-50(45-31-16-24-36-17-10-11-29-44(36)45)51-52(38-20-6-2-7-21-38)56-47-32-13-12-30-46(47)54(51)59-53/h1-35H.
What are the key properties of 2-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-3-naphthalen-1-yl-4-phenylfuro[3,2-c]quinoline?
2-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-3-naphthalen-1-yl-4-phenylfuro[3,2-c]quinoline has a molecular weight of 753.91 g/mol, XLogP of 14.59, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-3-naphthalen-1-yl-4-phenylfuro[3,2-c]quinoline is sourced from PubChem (CID 164716685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).