4-chloroimidazo[5,1-f][1,2,4]triazine

C5H3ClN4 — CID 45480448

IUPAC4-chloroimidazo[5,1-f][1,2,4]triazine
SMILESClc1ncnn2cncc12
InChIInChI=1S/C5H3ClN4/c6-5-4-1-7-3-10(4)9-2-8-5/h1-3H
InChIKeyYQKLYTZVBRYCJW-UHFFFAOYSA-N
MW154.56 g/mol
LogP0.78
Rot. Bonds

About 4-chloroimidazo[5,1-f][1,2,4]triazine

4-chloroimidazo[5,1-f][1,2,4]triazine (PubChem CID 45480448) has the molecular formula C5H3ClN4 and a molecular weight of 154.56 g/mol. Its IUPAC name is 4-chloroimidazo[5,1-f][1,2,4]triazine.

Molecular Properties

Compound Name4-chloroimidazo[5,1-f][1,2,4]triazine
PubChem CID45480448
Molecular FormulaC5H3ClN4
Molecular Weight154.56 g/mol
Exact Mass154.00
IUPAC Name4-chloroimidazo[5,1-f][1,2,4]triazine
SMILESClc1ncnn2cncc12
InChIInChI=1S/C5H3ClN4/c6-5-4-1-7-3-10(4)9-2-8-5/h1-3H
InChIKeyYQKLYTZVBRYCJW-UHFFFAOYSA-N
XLogP0.78
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.56
LogP ≤ 50.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-chloroimidazo[5,1-f][1,2,4]triazine?
The IUPAC name of 4-chloroimidazo[5,1-f][1,2,4]triazine (CID 45480448) is 4-chloroimidazo[5,1-f][1,2,4]triazine.
What is the SMILES notation for 4-chloroimidazo[5,1-f][1,2,4]triazine?
The canonical SMILES for 4-chloroimidazo[5,1-f][1,2,4]triazine is Clc1ncnn2cncc12.
What is the InChIKey of 4-chloroimidazo[5,1-f][1,2,4]triazine?
The InChIKey is YQKLYTZVBRYCJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3ClN4/c6-5-4-1-7-3-10(4)9-2-8-5/h1-3H.
What are the key properties of 4-chloroimidazo[5,1-f][1,2,4]triazine?
4-chloroimidazo[5,1-f][1,2,4]triazine has a molecular weight of 154.56 g/mol, XLogP of 0.78, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloroimidazo[5,1-f][1,2,4]triazine is sourced from PubChem (CID 45480448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).