6-bromo-2,3-dichloropyrido[2,3-b]pyrazine

C7H2BrCl2N3 — CID 154728648

IUPAC6-bromo-2,3-dichloropyrido[2,3-b]pyrazine
SMILESClc1nc2ccc(Br)nc2nc1Cl
InChIInChI=1S/C7H2BrCl2N3/c8-4-2-1-3-7(12-4)13-6(10)5(9)11-3/h1-2H
InChIKeyLKAZZLBPPMSVBL-UHFFFAOYSA-N
MW278.92 g/mol
LogP3.09
Rot. Bonds

About 6-bromo-2,3-dichloropyrido[2,3-b]pyrazine

6-bromo-2,3-dichloropyrido[2,3-b]pyrazine (PubChem CID 154728648) has the molecular formula C7H2BrCl2N3 and a molecular weight of 278.92 g/mol. Its IUPAC name is 6-bromo-2,3-dichloropyrido[2,3-b]pyrazine.

Molecular Properties

Compound Name6-bromo-2,3-dichloropyrido[2,3-b]pyrazine
PubChem CID154728648
Molecular FormulaC7H2BrCl2N3
Molecular Weight278.92 g/mol
Exact Mass276.88
IUPAC Name6-bromo-2,3-dichloropyrido[2,3-b]pyrazine
SMILESClc1nc2ccc(Br)nc2nc1Cl
InChIInChI=1S/C7H2BrCl2N3/c8-4-2-1-3-7(12-4)13-6(10)5(9)11-3/h1-2H
InChIKeyLKAZZLBPPMSVBL-UHFFFAOYSA-N
XLogP3.09
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.92
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2,3-dichloropyrido[2,3-b]pyrazine?
The IUPAC name of 6-bromo-2,3-dichloropyrido[2,3-b]pyrazine (CID 154728648) is 6-bromo-2,3-dichloropyrido[2,3-b]pyrazine.
What is the SMILES notation for 6-bromo-2,3-dichloropyrido[2,3-b]pyrazine?
The canonical SMILES for 6-bromo-2,3-dichloropyrido[2,3-b]pyrazine is Clc1nc2ccc(Br)nc2nc1Cl.
What is the InChIKey of 6-bromo-2,3-dichloropyrido[2,3-b]pyrazine?
The InChIKey is LKAZZLBPPMSVBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H2BrCl2N3/c8-4-2-1-3-7(12-4)13-6(10)5(9)11-3/h1-2H.
What are the key properties of 6-bromo-2,3-dichloropyrido[2,3-b]pyrazine?
6-bromo-2,3-dichloropyrido[2,3-b]pyrazine has a molecular weight of 278.92 g/mol, XLogP of 3.09, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2,3-dichloropyrido[2,3-b]pyrazine is sourced from PubChem (CID 154728648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).