2H,3H-pyrazolo[3,2-b][1,3]thiazole-7-carboxylic acid

2H,3H-pyrazolo[3,2-b][1,3]thiazole-7-carboxylic acid

CAS: 933753-92-5

Formula: C6H6N2O2S

SMILES: OC(=O)C1=C2SCCN2N=C1

IUPAC: 2H,3H-pyrazolo[3,2-b][1,3]thiazole-7-carboxylic acid

InChI: InChI=1S/C6H6N2O2S/c9-6(10)4-3-7-8-1-2-11-5(4)8/h3H,1-2H2,(H,9,10)

Composition: C (42.35%), H (3.55%), N (16.46%), O (18.80%), S (18.84%)

Molar Mass: 170.19

Atom Count: 17

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	170.014998615
Formal Charge	0
FSP3	0.33
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	ZOEZAYVCCMJVCR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.46
Topological Polar Surface Area	55.12
Polarizability	15.5
Ring Count	2
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	933753-92-5		$171.35-$2,748.50$171.35$227.70$342.70$457.70$687.70$2,748.50