5-Amino-1,2,4-thiadiazole

C₂H₃N₃SCAS 7552-07-0101.13 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₂H₃N₃S
Molar mass: 101.13 g/mol
Exact mass: 101.0048 Da
logP: 0.12Crippen estimate
Polar surface area: 51.8 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 0

Hazards

Warning

H302+H332 Harmful if swallowed or if inhaled95% of notifiers
H302 Harmful if swallowed100% of notifiers
H332 Harmful if inhaled100% of notifiers

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P270, P271, P301+P317, P304+P340, P317, P330, P501

Identifiers

CAS number

7552-07-0

SMILES

C1=NSC(=N1)N

InChIKey

VJHTZTZXOKVQRN-UHFFFAOYSA-N

InChI

InChI=1S/C2H3N3S/c3-2-4-1-5-6-2/h1H,(H2,3,4,5)

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 5-Amino-1,2,4-thiadiazole

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

5-Fluorothiazol-2-amine hydrochloride745053-64-930 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Mercapto-1,2,4-triazole3179-31-5 1,3,4-Thiadiazol-2-amine4005-51-0 1,2,3-Thiadiazol-5-amine4100-41-8

Elsewhere

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