4-Thiophen-2-yl-thiazol-2-ylamine

C₇H₆N₂S₂CAS 28989-50-6182.26 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₆N₂S₂
Molar mass: 182.26 g/mol
Exact mass: 181.9972 Da
logP: 2.45Crippen estimate
Polar surface area: 38.9 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed97.6% of notifiers
H319 Causes serious eye irritation100% of notifiers

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, P501

Identifiers

CAS number

28989-50-6

SMILES

C1=CSC(=C1)C2=CSC(=N2)N

InChIKey

XRNPDKQNHIKARG-UHFFFAOYSA-N

InChI

InChI=1S/C7H6N2S2/c8-7-9-5(4-11-7)6-2-1-3-10-6/h1-4H,(H2,8,9)

Weigh it out

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

Names and synonyms

1 names

4-(2-Thienyl)-1,3-thiazol-2-amine

Work with 4-Thiophen-2-yl-thiazol-2-ylamine

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

4-(5-Chloro-2-thienyl)-1,3-thiazol-2-amine123971-45-953 % similar 4-(5-Bromothiophen-2-yl)-1,3-thiazol-2-amine34801-14-453 % similar 4-(4-Chlorothiophen-2-yl)-1,3-thiazol-2-amine570407-10-251 % similar 4-Pyridin-4-yl-thiazol-2-ylamine30235-28-050 % similar 4-(4-Methylphenyl)-1,3-thiazol-2(3H)-imine2103-91-547 % similar 4-(4-Bromophenyl)-1,3-thiazol-2-amine2103-94-847 % similar 4-(4-Fluorophenyl)-1,3-thiazol-2-amine77815-14-647 % similar 4-(3-Bromo-phenyl)-thiazol-2-ylamine105512-81-046 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

6-Amino-2-mercaptobenzothiazole7442-07-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook