chempirical

5-Methoxy-2-benzothiazolamine

C8H8N2OSCAS 54346-87-1180.23 g/mol

Open in Covalent MOL file
OSNHNH
Ether

Properties

Molecular formula
C8H8N2OS
Molar mass
180.23 g/mol
Exact mass
180.0357 Da
Melting point
154 °C
logP
1.72Crippen estimate
Polar surface area
48.9 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
1

Identifiers

CAS number
54346-87-1
SMILES
COc1ccc2sc(=N)[nH]c2c1
InChIKey
OMIHQJBWAPWLBO-UHFFFAOYSA-N
InChI
InChI=1S/C8H8N2OS/c1-11-5-2-3-7-6(4-5)10-8(9)12-7/h2-4H,1H3,(H2,9,10)

Weigh it out

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

Names and synonyms

5 names
  • 2-Benzothiazolamine, 5-methoxy-
  • Benzothiazole, 2-amino-5-methoxy-
  • 2-Amino-5-methoxybenzothiazole
  • (5-Methoxybenzothiazol-2-yl)amine
  • 5-Methoxybenzo[d]thiazol-2-amine

Work with 5-Methoxy-2-benzothiazolamine

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-Methyl-2-benzothiazolamine14779-17-057 % similar 5-Chloro-2-benzothiazolamine20358-00-353 % similar 5-Bromo-2-benzothiazolamine20358-03-653 % similar 2-Amino-6-ethoxybenzothiazole94-45-149 % similar 5,6-Dimethyl-2-benzothiazolamine29927-08-047 % similar 2-Aminobenzothiazole136-95-847 % similar Riluzole1744-22-545 % similar 2-Amino-4-(4-methoxyphenyl)thiazole2104-04-344 % similar

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

Same formula

2-Amino-6-methoxybenzothiazole1747-60-0 2-Mercapto-5-methoxybenzimidazole37052-78-1 4-Methoxy-2-benzothiazolamine5464-79-9 Benzoylthiourea614-23-3

Elsewhere

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