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2-(pyrazin-2-yl)-1,3-thiazole-4-carboxylic acid

2-(pyrazin-2-yl)-1,3-thiazole-4-carboxylic acid

CAS: 115311-44-9

Formula: C8H5N3O2S

SMILES: OC(=O)C1=CSC(=N1)C1=CN=CC=N1

IUPAC: 2-(pyrazin-2-yl)-1,3-thiazole-4-carboxylic acid

InChI: InChI=1S/C8H5N3O2S/c12-8(13)6-4-14-7(11-6)5-3-9-1-2-10-5/h1-4H,(H,12,13)

Composition: C (46.37%), H (2.43%), N (20.28%), O (15.44%), S (15.47%)

Molar Mass: 207.21

Atom Count: 19

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 207.010247587
Formal Charge 0
FSP3 0
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey FVGINDDZLLHQKO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.57
Topological Polar Surface Area 75.97
Polarizability 19.05
Ring Count 2
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 115311-44-9 $336.89$336.89
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