AC1O46NM

4-(3-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl)benzene-1,2,3-triol;hydrochloride

Also Known As: 1,2,3-Benzenetriol, 4-(3-methyl-7H-1,2,4-triazolo(3,4-b)(1,3,4)thiadiazin-6-yl)-, monohydrochloride|(4E)-2,3-dihydroxy-4-(3-methyl-5H-[1,2,4]triazolo[3,4-b][1,3|4-(3-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl)benzene-1,2,3-triol|(4E)-2,3-dihydroxy-4-(3-methyl-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-ylidene)cyclohexa-2,5-dien-1-one hydrochloride|1,2,3-Benzenetriol, 4-(3-methyl-7H-1,2,4-triazolo[3,4-b][1,3,4]thiadiazin-6-yl)-, hydrochloride (1:1)|1,2,3-Benzenetriol, 4-(3-methyl-7H-1,2,4-triazolo[3,4-b][1,3,4]thiadiazin-6-yl)-, monohydrochloride|4-(3-Methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl)benzene-1,2,3-triol--hydrogen chloride (1/1)|4-{3-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl}benzene-1,2,3-triol hydrochloride

Molecular Formula	C11H11ClN4O3S
Molecular Weight	314.02405 g/mol
LogP	1.48322
Topological Polar Surface Area	129.0 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	7
Rotatable Bonds	1
Exact Mass	314.02405
Monoisotopic Mass	314.02405
Heavy Atoms	20
Complexity	383.0

Chemical Identifiers

CAS Number	69560-92-5
SMILES	CC1=NN=C2N1N=C(CS2)C3=C(C(=C(C=C3)O)O)O.Cl
InChIKey	GMQXWRCXHDTGII-UHFFFAOYSA-N