5,8-dichloropyrazino[2,3-d]pyridazine

C6H2Cl2N4 — CID 14709714

IUPAC5,8-dichloropyrazino[2,3-d]pyridazine
SMILESClc1nnc(Cl)c2nccnc12
InChIInChI=1S/C6H2Cl2N4/c7-5-3-4(6(8)12-11-5)10-2-1-9-3/h1-2H
InChIKeyNTGDKCOBTQISBV-UHFFFAOYSA-N
MW201.02 g/mol
LogP1.73
Rot. Bonds

About 5,8-dichloropyrazino[2,3-d]pyridazine

5,8-dichloropyrazino[2,3-d]pyridazine (PubChem CID 14709714) has the molecular formula C6H2Cl2N4 and a molecular weight of 201.02 g/mol. Its IUPAC name is 5,8-dichloropyrazino[2,3-d]pyridazine.

Molecular Properties

Compound Name5,8-dichloropyrazino[2,3-d]pyridazine
PubChem CID14709714
Molecular FormulaC6H2Cl2N4
Molecular Weight201.02 g/mol
Exact Mass199.97
IUPAC Name5,8-dichloropyrazino[2,3-d]pyridazine
SMILESClc1nnc(Cl)c2nccnc12
InChIInChI=1S/C6H2Cl2N4/c7-5-3-4(6(8)12-11-5)10-2-1-9-3/h1-2H
InChIKeyNTGDKCOBTQISBV-UHFFFAOYSA-N
XLogP1.73
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.02
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5,8-dichloropyrazino[2,3-d]pyridazine?
The IUPAC name of 5,8-dichloropyrazino[2,3-d]pyridazine (CID 14709714) is 5,8-dichloropyrazino[2,3-d]pyridazine.
What is the SMILES notation for 5,8-dichloropyrazino[2,3-d]pyridazine?
The canonical SMILES for 5,8-dichloropyrazino[2,3-d]pyridazine is Clc1nnc(Cl)c2nccnc12.
What is the InChIKey of 5,8-dichloropyrazino[2,3-d]pyridazine?
The InChIKey is NTGDKCOBTQISBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2Cl2N4/c7-5-3-4(6(8)12-11-5)10-2-1-9-3/h1-2H.
What are the key properties of 5,8-dichloropyrazino[2,3-d]pyridazine?
5,8-dichloropyrazino[2,3-d]pyridazine has a molecular weight of 201.02 g/mol, XLogP of 1.73, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,8-dichloropyrazino[2,3-d]pyridazine is sourced from PubChem (CID 14709714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).