4-(2,4-difluorophenoxy)-7-methoxyquinazoline

C15H10F2N2O2 — CID 90645328

IUPAC4-(2,4-difluorophenoxy)-7-methoxyquinazoline
SMILESCOc1ccc2c(Oc3ccc(F)cc3F)ncnc2c1
InChIInChI=1S/C15H10F2N2O2/c1-20-10-3-4-11-13(7-10)18-8-19-15(11)21-14-5-2-9(16)6-12(14)17/h2-8H,1H3
InChIKeyDKBGJIILYWWMRH-UHFFFAOYSA-N
MW288.25 g/mol
LogP3.71
Rot. Bonds3

About 4-(2,4-difluorophenoxy)-7-methoxyquinazoline

4-(2,4-difluorophenoxy)-7-methoxyquinazoline (PubChem CID 90645328) has the molecular formula C15H10F2N2O2 and a molecular weight of 288.25 g/mol. Its IUPAC name is 4-(2,4-difluorophenoxy)-7-methoxyquinazoline.

Molecular Properties

Compound Name4-(2,4-difluorophenoxy)-7-methoxyquinazoline
PubChem CID90645328
Molecular FormulaC15H10F2N2O2
Molecular Weight288.25 g/mol
Exact Mass288.07
IUPAC Name4-(2,4-difluorophenoxy)-7-methoxyquinazoline
SMILESCOc1ccc2c(Oc3ccc(F)cc3F)ncnc2c1
InChIInChI=1S/C15H10F2N2O2/c1-20-10-3-4-11-13(7-10)18-8-19-15(11)21-14-5-2-9(16)6-12(14)17/h2-8H,1H3
InChIKeyDKBGJIILYWWMRH-UHFFFAOYSA-N
XLogP3.71
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.25
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2,4-difluorophenoxy)-7-methoxyquinazoline?
The IUPAC name of 4-(2,4-difluorophenoxy)-7-methoxyquinazoline (CID 90645328) is 4-(2,4-difluorophenoxy)-7-methoxyquinazoline.
What is the SMILES notation for 4-(2,4-difluorophenoxy)-7-methoxyquinazoline?
The canonical SMILES for 4-(2,4-difluorophenoxy)-7-methoxyquinazoline is COc1ccc2c(Oc3ccc(F)cc3F)ncnc2c1.
What is the InChIKey of 4-(2,4-difluorophenoxy)-7-methoxyquinazoline?
The InChIKey is DKBGJIILYWWMRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F2N2O2/c1-20-10-3-4-11-13(7-10)18-8-19-15(11)21-14-5-2-9(16)6-12(14)17/h2-8H,1H3.
What are the key properties of 4-(2,4-difluorophenoxy)-7-methoxyquinazoline?
4-(2,4-difluorophenoxy)-7-methoxyquinazoline has a molecular weight of 288.25 g/mol, XLogP of 3.71, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-difluorophenoxy)-7-methoxyquinazoline is sourced from PubChem (CID 90645328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).