2,4-dichloro-6-fluoro-7-methoxypyrido[2,3-d]pyrimidine

C8H4Cl2FN3O — CID 141311433

IUPAC2,4-dichloro-6-fluoro-7-methoxypyrido[2,3-d]pyrimidine
SMILESCOc1nc2nc(Cl)nc(Cl)c2cc1F
InChIInChI=1S/C8H4Cl2FN3O/c1-15-7-4(11)2-3-5(9)12-8(10)14-6(3)13-7/h2H,1H3
InChIKeyAPYKOGLCRWMUOD-UHFFFAOYSA-N
MW248.04 g/mol
LogP2.48
Rot. Bonds1

About 2,4-dichloro-6-fluoro-7-methoxypyrido[2,3-d]pyrimidine

2,4-dichloro-6-fluoro-7-methoxypyrido[2,3-d]pyrimidine (PubChem CID 141311433) has the molecular formula C8H4Cl2FN3O and a molecular weight of 248.04 g/mol. Its IUPAC name is 2,4-dichloro-6-fluoro-7-methoxypyrido[2,3-d]pyrimidine.

Molecular Properties

Compound Name2,4-dichloro-6-fluoro-7-methoxypyrido[2,3-d]pyrimidine
PubChem CID141311433
Molecular FormulaC8H4Cl2FN3O
Molecular Weight248.04 g/mol
Exact Mass246.97
IUPAC Name2,4-dichloro-6-fluoro-7-methoxypyrido[2,3-d]pyrimidine
SMILESCOc1nc2nc(Cl)nc(Cl)c2cc1F
InChIInChI=1S/C8H4Cl2FN3O/c1-15-7-4(11)2-3-5(9)12-8(10)14-6(3)13-7/h2H,1H3
InChIKeyAPYKOGLCRWMUOD-UHFFFAOYSA-N
XLogP2.48
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.04
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2,4-dichloro-6-fluoro-7-methoxypyrido[2,3-d]pyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-fluoro-7-methoxypyrido[2,3-d]pyrimidine?
The IUPAC name of 2,4-dichloro-6-fluoro-7-methoxypyrido[2,3-d]pyrimidine (CID 141311433) is 2,4-dichloro-6-fluoro-7-methoxypyrido[2,3-d]pyrimidine.
What is the SMILES notation for 2,4-dichloro-6-fluoro-7-methoxypyrido[2,3-d]pyrimidine?
The canonical SMILES for 2,4-dichloro-6-fluoro-7-methoxypyrido[2,3-d]pyrimidine is COc1nc2nc(Cl)nc(Cl)c2cc1F.
What is the InChIKey of 2,4-dichloro-6-fluoro-7-methoxypyrido[2,3-d]pyrimidine?
The InChIKey is APYKOGLCRWMUOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4Cl2FN3O/c1-15-7-4(11)2-3-5(9)12-8(10)14-6(3)13-7/h2H,1H3.
What are the key properties of 2,4-dichloro-6-fluoro-7-methoxypyrido[2,3-d]pyrimidine?
2,4-dichloro-6-fluoro-7-methoxypyrido[2,3-d]pyrimidine has a molecular weight of 248.04 g/mol, XLogP of 2.48, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-fluoro-7-methoxypyrido[2,3-d]pyrimidine is sourced from PubChem (CID 141311433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).