7-bromo-4-chloropyrido[3,2-c]pyridazine

C7H3BrClN3 — CID 162682576

IUPAC7-bromo-4-chloropyrido[3,2-c]pyridazine
SMILESClc1cnnc2cc(Br)cnc12
InChIInChI=1S/C7H3BrClN3/c8-4-1-6-7(10-2-4)5(9)3-11-12-6/h1-3H
InChIKeyWAZSFXZLVRYKJN-UHFFFAOYSA-N
MW244.48 g/mol
LogP2.44
Rot. Bonds

About 7-bromo-4-chloropyrido[3,2-c]pyridazine

7-bromo-4-chloropyrido[3,2-c]pyridazine (PubChem CID 162682576) has the molecular formula C7H3BrClN3 and a molecular weight of 244.48 g/mol. Its IUPAC name is 7-bromo-4-chloropyrido[3,2-c]pyridazine.

Molecular Properties

Compound Name7-bromo-4-chloropyrido[3,2-c]pyridazine
PubChem CID162682576
Molecular FormulaC7H3BrClN3
Molecular Weight244.48 g/mol
Exact Mass242.92
IUPAC Name7-bromo-4-chloropyrido[3,2-c]pyridazine
SMILESClc1cnnc2cc(Br)cnc12
InChIInChI=1S/C7H3BrClN3/c8-4-1-6-7(10-2-4)5(9)3-11-12-6/h1-3H
InChIKeyWAZSFXZLVRYKJN-UHFFFAOYSA-N
XLogP2.44
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.48
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-bromo-4-chloropyrido[3,2-c]pyridazine?
The IUPAC name of 7-bromo-4-chloropyrido[3,2-c]pyridazine (CID 162682576) is 7-bromo-4-chloropyrido[3,2-c]pyridazine.
What is the SMILES notation for 7-bromo-4-chloropyrido[3,2-c]pyridazine?
The canonical SMILES for 7-bromo-4-chloropyrido[3,2-c]pyridazine is Clc1cnnc2cc(Br)cnc12.
What is the InChIKey of 7-bromo-4-chloropyrido[3,2-c]pyridazine?
The InChIKey is WAZSFXZLVRYKJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3BrClN3/c8-4-1-6-7(10-2-4)5(9)3-11-12-6/h1-3H.
What are the key properties of 7-bromo-4-chloropyrido[3,2-c]pyridazine?
7-bromo-4-chloropyrido[3,2-c]pyridazine has a molecular weight of 244.48 g/mol, XLogP of 2.44, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-4-chloropyrido[3,2-c]pyridazine is sourced from PubChem (CID 162682576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).