chempirical

2-Amino-4-thiazoleacetic acid

C5H6N2O2SCAS 29676-71-9158.17 g/mol

Open in Covalent MOL file
HNHNOOHS
Carboxylic acid

Properties

Molecular formula
C5H6N2O2S
Molar mass
158.17 g/mol
Exact mass
158.0150 Da
logP
0.18Crippen estimate
Polar surface area
76.9 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
2

Identifiers

CAS number
29676-71-9
SMILES
N=c1[nH]c(CC(=O)O)cs1
InChIKey
DYCLHZPOADTVKK-UHFFFAOYSA-N
InChI
InChI=1S/C5H6N2O2S/c6-5-7-3(2-10-5)1-4(8)9/h2H,1H2,(H2,6,7)(H,8,9)

Weigh it out

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

Names and synonyms

11 names
  • 4-Thiazoleacetic acid, 2-amino-
  • 2-Aminothiazole-4-acetic acid
  • 2-Amino-4-thiazolylacetic acid
  • SQ 272
  • (2-Amino-4-thiazoyl)acetic acid
  • 2-(2-Amino-4-thiazolyl)acetic acid
  • (2-Amino-1,3-thiazol-4-yl)acetic acid
  • 2-Aminothiazol-4-acetic acid
  • 2-(2-Amino-4-thiazole)acetic acid
  • 2-(2-Amino-1,3-thiazol-4-yl)acetic acid
  • 2-(2-Azaniumyl-1,3-thiazol-4-yl)acetate

Work with 2-Amino-4-thiazoleacetic acid

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

Ethyl 2-amino-4-thiazoleacetate53266-94-754 % similar 2-Amino-α-oxo-4-thiazoleacetic acid73150-67-147 % similar 4-(Chloromethyl)-2-thiazolamine hydrochloride59608-97-846 % similar Thiophene-2-acetic acid1918-77-043 % similar 1H-Imidazole-5-acetic acid645-65-842 % similar Ethyl 2-amino-4-thiazolecarboxylate5398-36-741 % similar Thiophene-3-acetic acid6964-21-241 % similar 1,4-Benzenediacetic acid7325-46-439 % similar

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

Same formula

Methyl 2-amino-1,3-thiazole-4-carboxylate118452-04-3 4,6-Dihydroxy-2-(methylthio)pyrimidine1979-98-2 Ethyl 1,2,3-thiadiazole-4-carboxylate3989-36-4

Elsewhere

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