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MFCD09842617 molecular structure
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5-chloroimidazo[1,2-a]pyridine-2-carbohydrazide

ChemBase ID: 73855
Molecular Formular: C8H7ClN4O
Molecular Mass: 210.62038
Monoisotopic Mass: 210.03083854
SMILES and InChIs

SMILES:
n12c(nc(c1)C(=O)NN)cccc2Cl
Canonical SMILES:
NNC(=O)c1cn2c(n1)cccc2Cl
InChI:
InChI=1S/C8H7ClN4O/c9-6-2-1-3-7-11-5(4-13(6)7)8(14)12-10/h1-4H,10H2,(H,12,14)
InChIKey:
BAHXRQQRIQTGNE-UHFFFAOYSA-N

Cite this record

CBID:73855 http://www.chembase.cn/molecule-73855.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
5-chloroimidazo[1,2-a]pyridine-2-carbohydrazide
IUPAC Traditional name
5-chloroimidazo[1,2-a]pyridine-2-carbohydrazide
Synonyms
5-Chloroimidazo[1,2-a]pyridine-2-carboxylic acid hydrazide
5-Chloroimidazo[1,2-a]pyridine-2-carbohydrazide
MDL Number
MFCD09842617
PubChem SID
162038774
PubChem CID
26369190

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Apollo Scientific
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Data Source Data ID
PubChem 26369190 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 14.11298  H Acceptors
H Donor LogD (pH = 5.5) 0.015137147 
LogD (pH = 7.4) 0.01857556  Log P 0.018619683 
Molar Refractivity 53.9328 cm3 Polarizability 19.538198 Å3
Polar Surface Area 72.42 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Bioassay(PubChem)
Storage Warning
Irritant expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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