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1159821-51-8 molecular structure
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2-(pyridin-3-yl)-1,3-thiazol-5-amine

ChemBase ID: 308922
Molecular Formular: C8H7N3S
Molecular Mass: 177.22628
Monoisotopic Mass: 177.03606824
SMILES and InChIs

SMILES:
c1(sc(cn1)N)c1cnccc1
Canonical SMILES:
Nc1cnc(s1)c1cccnc1
InChI:
InChI=1S/C8H7N3S/c9-7-5-11-8(12-7)6-2-1-3-10-4-6/h1-5H,9H2
InChIKey:
MUNKBMPBTNZCTE-UHFFFAOYSA-N

Cite this record

CBID:308922 http://www.chembase.cn/molecule-308922.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-(pyridin-3-yl)-1,3-thiazol-5-amine
IUPAC Traditional name
2-(pyridin-3-yl)-1,3-thiazol-5-amine
Synonyms
2-(3-pyridinyl)-1,3-thiazol-5-amine
CAS Number
1159821-51-8
MDL Number
MFCD12033412

DATA SOURCES

DATA SOURCES

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Data Source Data ID
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Data Source Data ID Price
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CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 0.7604243  LogD (pH = 7.4) 0.77600384 
Log P 0.77620643  Molar Refractivity 58.0714 cm3
Polarizability 18.613571 Å3 Polar Surface Area 51.8 Å2

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

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