2-(4-naphthalen-2-yloxyquinazolin-2-yl)phenol

C24H16N2O2 — CID 2015679

IUPAC2-(4-naphthalen-2-yloxyquinazolin-2-yl)phenol
SMILESOc1ccccc1-c1nc(Oc2ccc3ccccc3c2)c2ccccc2n1
InChIInChI=1S/C24H16N2O2/c27-22-12-6-4-10-20(22)23-25-21-11-5-3-9-19(21)24(26-23)28-18-14-13-16-7-1-2-8-17(16)15-18/h1-15,27H
InChIKeyOZNXYXJPDFLARF-UHFFFAOYSA-N
MW364.40 g/mol
LogP5.95
Rot. Bonds3

About 2-(4-naphthalen-2-yloxyquinazolin-2-yl)phenol

2-(4-naphthalen-2-yloxyquinazolin-2-yl)phenol (PubChem CID 2015679) has the molecular formula C24H16N2O2 and a molecular weight of 364.40 g/mol. Its IUPAC name is 2-(4-naphthalen-2-yloxyquinazolin-2-yl)phenol.

Molecular Properties

Compound Name2-(4-naphthalen-2-yloxyquinazolin-2-yl)phenol
PubChem CID2015679
Molecular FormulaC24H16N2O2
Molecular Weight364.40 g/mol
Exact Mass364.12
IUPAC Name2-(4-naphthalen-2-yloxyquinazolin-2-yl)phenol
SMILESOc1ccccc1-c1nc(Oc2ccc3ccccc3c2)c2ccccc2n1
InChIInChI=1S/C24H16N2O2/c27-22-12-6-4-10-20(22)23-25-21-11-5-3-9-19(21)24(26-23)28-18-14-13-16-7-1-2-8-17(16)15-18/h1-15,27H
InChIKeyOZNXYXJPDFLARF-UHFFFAOYSA-N
XLogP5.95
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.40
LogP ≤ 55.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-naphthalen-2-yloxyquinazolin-2-yl)phenol?
The IUPAC name of 2-(4-naphthalen-2-yloxyquinazolin-2-yl)phenol (CID 2015679) is 2-(4-naphthalen-2-yloxyquinazolin-2-yl)phenol.
What is the SMILES notation for 2-(4-naphthalen-2-yloxyquinazolin-2-yl)phenol?
The canonical SMILES for 2-(4-naphthalen-2-yloxyquinazolin-2-yl)phenol is Oc1ccccc1-c1nc(Oc2ccc3ccccc3c2)c2ccccc2n1.
What is the InChIKey of 2-(4-naphthalen-2-yloxyquinazolin-2-yl)phenol?
The InChIKey is OZNXYXJPDFLARF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16N2O2/c27-22-12-6-4-10-20(22)23-25-21-11-5-3-9-19(21)24(26-23)28-18-14-13-16-7-1-2-8-17(16)15-18/h1-15,27H.
What are the key properties of 2-(4-naphthalen-2-yloxyquinazolin-2-yl)phenol?
2-(4-naphthalen-2-yloxyquinazolin-2-yl)phenol has a molecular weight of 364.40 g/mol, XLogP of 5.95, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-naphthalen-2-yloxyquinazolin-2-yl)phenol is sourced from PubChem (CID 2015679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).