imidazo[2,1-b][1,3]thiazole-5-carboxylic acid

imidazo[2,1-b][1,3]thiazole-5-carboxylic acid

CAS: 17782-81-9

Formula: C6H4N2O2S

SMILES: OC(=O)C1=CN=C2SC=CN12

IUPAC: imidazo[2,1-b][1,3]thiazole-5-carboxylic acid

InChI: InChI=1S/C6H4N2O2S/c9-5(10)4-3-7-6-8(4)1-2-11-6/h1-3H,(H,9,10)

Composition: C (42.85%), H (2.40%), N (16.66%), O (19.03%), S (19.06%)

Molar Mass: 168.17

Atom Count: 15

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	167.999348551
Formal Charge	0
FSP3	0
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	ZGIABSKPSCMXFD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.65
Topological Polar Surface Area	54.6
Polarizability	14.47
Ring Count	2
Rotatable Bond Count	1

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