2,4-dichloro-6,7-difluoroquinazoline

C8H2Cl2F2N2 — CID 34181560

IUPAC2,4-dichloro-6,7-difluoroquinazoline
SMILESFc1cc2nc(Cl)nc(Cl)c2cc1F
InChIInChI=1S/C8H2Cl2F2N2/c9-7-3-1-4(11)5(12)2-6(3)13-8(10)14-7/h1-2H
InChIKeyOZRYUGTYKIGKMD-UHFFFAOYSA-N
MW235.02 g/mol
LogP3.21
Rot. Bonds

About 2,4-dichloro-6,7-difluoroquinazoline

2,4-dichloro-6,7-difluoroquinazoline (PubChem CID 34181560) has the molecular formula C8H2Cl2F2N2 and a molecular weight of 235.02 g/mol. Its IUPAC name is 2,4-dichloro-6,7-difluoroquinazoline.

Molecular Properties

Compound Name2,4-dichloro-6,7-difluoroquinazoline
PubChem CID34181560
Molecular FormulaC8H2Cl2F2N2
Molecular Weight235.02 g/mol
Exact Mass233.96
IUPAC Name2,4-dichloro-6,7-difluoroquinazoline
SMILESFc1cc2nc(Cl)nc(Cl)c2cc1F
InChIInChI=1S/C8H2Cl2F2N2/c9-7-3-1-4(11)5(12)2-6(3)13-8(10)14-7/h1-2H
InChIKeyOZRYUGTYKIGKMD-UHFFFAOYSA-N
XLogP3.21
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.02
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6,7-difluoroquinazoline?
The IUPAC name of 2,4-dichloro-6,7-difluoroquinazoline (CID 34181560) is 2,4-dichloro-6,7-difluoroquinazoline.
What is the SMILES notation for 2,4-dichloro-6,7-difluoroquinazoline?
The canonical SMILES for 2,4-dichloro-6,7-difluoroquinazoline is Fc1cc2nc(Cl)nc(Cl)c2cc1F.
What is the InChIKey of 2,4-dichloro-6,7-difluoroquinazoline?
The InChIKey is OZRYUGTYKIGKMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H2Cl2F2N2/c9-7-3-1-4(11)5(12)2-6(3)13-8(10)14-7/h1-2H.
What are the key properties of 2,4-dichloro-6,7-difluoroquinazoline?
2,4-dichloro-6,7-difluoroquinazoline has a molecular weight of 235.02 g/mol, XLogP of 3.21, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6,7-difluoroquinazoline is sourced from PubChem (CID 34181560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).