chempirical

1,3-Thiazole-2-carboximidamide hydrochloride

C4H6ClN3SCAS 247037-82-7163.62 g/mol

Open in Covalent MOL file
HClHNH2NNS
Amidine

Properties

Molecular formula
C4H6ClN3S
Molar mass
163.62 g/mol
Exact mass
162.9971 Da
logP
0.85Crippen estimate
Polar surface area
62.8 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
247037-82-7
SMILES
Cl.N=C(N)c1nccs1
InChIKey
MOIIOZOJYWYXEP-UHFFFAOYSA-N
InChI
InChI=1S/C4H5N3S.ClH/c5-3(6)4-7-1-2-8-4;/h1-2H,(H3,5,6);1H

Weigh it out

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

Names and synonyms

4 names
  • Thiazole-2-carboxamidine hydrochloride
  • 2-Thiazolecarboximidamide, hydrochloride (1:1)
  • 2-Thiazolecarboximidamide, monohydrochloride
  • 2-Thiazolecarboximidamide hydrochloride

Work with 1,3-Thiazole-2-carboximidamide hydrochloride

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

2-Amidinopyrimidine hydrochloride138588-40-648 % similar Pyrazine-2-carboxamidine hydrochloride138588-41-746 % similar 2-Amidinothiophene hydrochloride54610-70-746 % similar Pyridine-2-carboximidamide hydrochloride51285-26-844 % similar Thiazole-2-carboxylic acid14190-59-140 % similar 2-Acetylthiazole24295-03-240 % similar 3-Guanylpyridine hydrochloride7356-60-739 % similar Benzamidine hydrochloride1670-14-038 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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