3-(3-dibenzofuran-4-ylphenyl)-1-phenyl-2,7-naphthyridine

C32H20N2O — CID 118491237

IUPAC3-(3-dibenzofuran-4-ylphenyl)-1-phenyl-2,7-naphthyridine
SMILESc1ccc(-c2nc(-c3cccc(-c4cccc5c4oc4ccccc45)c3)cc3ccncc23)cc1
InChIInChI=1S/C32H20N2O/c1-2-8-21(9-3-1)31-28-20-33-17-16-23(28)19-29(34-31)24-11-6-10-22(18-24)25-13-7-14-27-26-12-4-5-15-30(26)35-32(25)27/h1-20H
InChIKeyPZQWZMXXMRAVHZ-UHFFFAOYSA-N
MW448.53 g/mol
LogP8.53
Rot. Bonds3

About 3-(3-dibenzofuran-4-ylphenyl)-1-phenyl-2,7-naphthyridine

3-(3-dibenzofuran-4-ylphenyl)-1-phenyl-2,7-naphthyridine (PubChem CID 118491237) has the molecular formula C32H20N2O and a molecular weight of 448.53 g/mol. Its IUPAC name is 3-(3-dibenzofuran-4-ylphenyl)-1-phenyl-2,7-naphthyridine.

Molecular Properties

Compound Name3-(3-dibenzofuran-4-ylphenyl)-1-phenyl-2,7-naphthyridine
PubChem CID118491237
Molecular FormulaC32H20N2O
Molecular Weight448.53 g/mol
Exact Mass448.16
IUPAC Name3-(3-dibenzofuran-4-ylphenyl)-1-phenyl-2,7-naphthyridine
SMILESc1ccc(-c2nc(-c3cccc(-c4cccc5c4oc4ccccc45)c3)cc3ccncc23)cc1
InChIInChI=1S/C32H20N2O/c1-2-8-21(9-3-1)31-28-20-33-17-16-23(28)19-29(34-31)24-11-6-10-22(18-24)25-13-7-14-27-26-12-4-5-15-30(26)35-32(25)27/h1-20H
InChIKeyPZQWZMXXMRAVHZ-UHFFFAOYSA-N
XLogP8.53
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500448.53
LogP ≤ 58.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[3-dibenzofuran-4-yl-5-(2-phenylphenyl)phenyl]-2-phenyl-6-pyridin-3-ylpyrimidine
CID 171585346
11-(3-dibenzofuran-4-ylphenyl)phenanthro[9,10-c]pyridine
CID 59575296
2-chloro-4-(3-dibenzofuran-4-ylphenyl)-6-phenylpyrimidine
CID 146489037
4-(3-dibenzofuran-4-yl-5-naphthalen-1-ylphenyl)-2-phenyl-6-(3-pyridin-3-ylphenyl)pyrimidine
CID 171584057
4-[3-dibenzofuran-4-yl-5-(2-phenylphenyl)phenyl]-2-phenyl-6-(2-pyridin-4-ylphenyl)pyrimidine
CID 171583144
4-dibenzofuran-4-yl-2-phenyl-6-(3-phenyl-5-pyridin-4-ylphenyl)pyrimidine
CID 154950185
2-dibenzofuran-4-yl-4-[3,5-di(dibenzofuran-4-yl)phenyl]-6-(4-phenylphenyl)pyrimidine
CID 130465872
2,4-bis(3-dibenzofuran-4-yl-5-phenylphenyl)-6-phenylpyrimidine
CID 171585319
2-[3,5-di(dibenzofuran-4-yl)phenyl]-4-phenyl-6-(3-pyrimidin-2-ylphenyl)pyrimidine
CID 130262741
4-(3-dibenzofuran-4-ylphenyl)-2-naphthalen-1-yl-6-(4-phenylphenyl)pyrimidine
CID 130465782
4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-2-[3-(2,3,5,6-tetraphenyl-4-pyridinyl)phenyl]pyrimidine
CID 158511636
4-[3-dibenzofuran-4-yl-5-(2-dibenzofuran-4-ylphenyl)phenyl]-2,6-diphenylpyrimidine
CID 171583012

Frequently Asked Questions

What is the IUPAC name of 3-(3-dibenzofuran-4-ylphenyl)-1-phenyl-2,7-naphthyridine?
The IUPAC name of 3-(3-dibenzofuran-4-ylphenyl)-1-phenyl-2,7-naphthyridine (CID 118491237) is 3-(3-dibenzofuran-4-ylphenyl)-1-phenyl-2,7-naphthyridine.
What is the SMILES notation for 3-(3-dibenzofuran-4-ylphenyl)-1-phenyl-2,7-naphthyridine?
The canonical SMILES for 3-(3-dibenzofuran-4-ylphenyl)-1-phenyl-2,7-naphthyridine is c1ccc(-c2nc(-c3cccc(-c4cccc5c4oc4ccccc45)c3)cc3ccncc23)cc1.
What is the InChIKey of 3-(3-dibenzofuran-4-ylphenyl)-1-phenyl-2,7-naphthyridine?
The InChIKey is PZQWZMXXMRAVHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H20N2O/c1-2-8-21(9-3-1)31-28-20-33-17-16-23(28)19-29(34-31)24-11-6-10-22(18-24)25-13-7-14-27-26-12-4-5-15-30(26)35-32(25)27/h1-20H.
What are the key properties of 3-(3-dibenzofuran-4-ylphenyl)-1-phenyl-2,7-naphthyridine?
3-(3-dibenzofuran-4-ylphenyl)-1-phenyl-2,7-naphthyridine has a molecular weight of 448.53 g/mol, XLogP of 8.53, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-dibenzofuran-4-ylphenyl)-1-phenyl-2,7-naphthyridine is sourced from PubChem (CID 118491237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).