Imidazo[1,2-a]pyridine hydrochloride

CAS Number: 34167-64-1
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c1cnc2n1cccc2.Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
HCl.C7H6N2
Molecular Weight
118.139
Drug-likeness
0.93945
CAS
34167-64-1
InChI key
UZXJSYJMGKHWBK-UHFFFAOYSA-N
SMILES
c1cnc2n1cccc2.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 34167-64-1
Molecule Name Imidazo[1,2-a]pyridine hydrochloride
Molecular Formula HCl.C7H6N2
SMILES c1cnc2n1cccc2.Cl
InChI InChI=1S/C7H6N2.ClH/c1-2-5-9-6-4-8-7(9)3-1;/h1-6H;1H
InChI Key UZXJSYJMGKHWBK-UHFFFAOYSA-N
CanonicalSyTyLFy 3422cb5fa9f9e887
TotalMolweight 154.6
Molecular Weight 118.139
MonoisotopicMass 118.053098
CLogP 0.6021
CLogS -2.897
H Acceptors 2
TotalSurfaceArea 97.27
Relative PSA 0.19451
PolarSurfaceArea 17.3
Drug-likeness 0.93945
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.55556
Molecular Complexity 0.71107
Fragments 2
Non HAtoms 9
NonCHAtoms 2
Electronegative Atoms 2
Rings Closures 2
Small Rings 2
Aromatic Rings 2
Aromatic Atoms 9
Aromatic Nitrogens 2
BasicNitrogens 1

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