7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline

C50H32N4O — CID 164716190

IUPAC7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc5c(c4)nc(-c4ccccc4)c4c(-c6ccccc6)c(-c6ccccc6)oc45)c3)n2)cc1
InChIInChI=1S/C50H32N4O/c1-6-17-33(18-7-1)43-44-45(34-19-8-2-9-20-34)51-42-32-39(29-30-41(42)47(44)55-46(43)35-21-10-3-11-22-35)38-27-16-28-40(31-38)50-53-48(36-23-12-4-13-24-36)52-49(54-50)37-25-14-5-15-26-37/h1-32H
InChIKeyMLVWTUDCBFPJJW-UHFFFAOYSA-N
MW704.83 g/mol
LogP12.84
Rot. Bonds7

About 7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline

7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline (PubChem CID 164716190) has the molecular formula C50H32N4O and a molecular weight of 704.83 g/mol. Its IUPAC name is 7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline.

Molecular Properties

Compound Name7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline
PubChem CID164716190
Molecular FormulaC50H32N4O
Molecular Weight704.83 g/mol
Exact Mass704.26
IUPAC Name7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc5c(c4)nc(-c4ccccc4)c4c(-c6ccccc6)c(-c6ccccc6)oc45)c3)n2)cc1
InChIInChI=1S/C50H32N4O/c1-6-17-33(18-7-1)43-44-45(34-19-8-2-9-20-34)51-42-32-39(29-30-41(42)47(44)55-46(43)35-21-10-3-11-22-35)38-27-16-28-40(31-38)50-53-48(36-23-12-4-13-24-36)52-49(54-50)37-25-14-5-15-26-37/h1-32H
InChIKeyMLVWTUDCBFPJJW-UHFFFAOYSA-N
XLogP12.84
TPSA64.70 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500704.83
LogP ≤ 512.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3,4-triphenylfuro[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

2-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-3,4-diphenylfuro[3,2-c]quinoline
CID 164716861
7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-naphthalen-2-yl-2,3-dipyridin-4-ylfuro[3,2-c]quinoline
CID 164716605
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
3,4-diphenyl-2-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]furo[3,2-c]quinoline
CID 164716850
3,4-diphenyl-2-[3-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]furo[3,2-c]quinoline
CID 164716638
2,3,4-triphenyl-8-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]furo[3,2-c]quinoline
CID 164716014
6-phenyl-3-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-[1]benzofuro[3,2-c]quinoline
CID 157091257
2,4-diphenyl-1-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]furo[2,3-c]quinoline
CID 164716397
2,3,4-triphenyl-8-[4-(2-phenylquinazolin-4-yl)phenyl]furo[3,2-c]quinoline
CID 164716866
8-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-naphthalen-2-yl-2,3-diphenylfuro[3,2-c]quinoline
CID 164716017
2,3,4-triphenyl-8-[4-(4-phenylphenyl)quinazolin-2-yl]furo[3,2-c]quinoline
CID 164716970
6-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-3-phenyl-[1]benzofuro[3,2-c]quinoline
CID 146497836

Frequently Asked Questions

What is the IUPAC name of 7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline?
The IUPAC name of 7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline (CID 164716190) is 7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline.
What is the SMILES notation for 7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline?
The canonical SMILES for 7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline is c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc5c(c4)nc(-c4ccccc4)c4c(-c6ccccc6)c(-c6ccccc6)oc45)c3)n2)cc1.
What is the InChIKey of 7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline?
The InChIKey is MLVWTUDCBFPJJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H32N4O/c1-6-17-33(18-7-1)43-44-45(34-19-8-2-9-20-34)51-42-32-39(29-30-41(42)47(44)55-46(43)35-21-10-3-11-22-35)38-27-16-28-40(31-38)50-53-48(36-23-12-4-13-24-36)52-49(54-50)37-25-14-5-15-26-37/h1-32H.
What are the key properties of 7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline?
7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline has a molecular weight of 704.83 g/mol, XLogP of 12.84, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline is sourced from PubChem (CID 164716190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).