chempirical

2-Amino-6-methoxybenzothiazole

C8H8N2OSCAS 1747-60-0180.22 g/mol

Open in Covalent MOL file
ONHNHS
Ether

Properties

Molecular formula
C8H8N2OS
Molar mass
180.22 g/mol
Exact mass
180.0357 Da
Melting point
158 °C
logP
1.72Crippen estimate
Polar surface area
48.9 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
1

Identifiers

CAS number
1747-60-0
SMILES
COc1ccc2[nH]c(=N)sc2c1
InChIKey
KZHGPDSVHSDCMX-UHFFFAOYSA-N
InChI
InChI=1S/C8H8N2OS/c1-11-5-2-3-6-7(4-5)12-8(9)10-6/h2-4H,1H3,(H2,9,10)

Weigh it out

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

Names and synonyms

10 names
  • 2-Benzothiazolamine, 6-methoxy-
  • Benzothiazole, 2-amino-6-methoxy-
  • 6-Methoxy-2-benzothiazolamine
  • 6-Methoxy-2-aminobenzothiazole
  • 6-Methoxy-1,3-benzothiazol-2-ylamine
  • NSC 27516
  • (6-Methoxybenzothiazol-2-yl)amine
  • 6-Methoxybenzo[d]thiazol-2-amine
  • 6-Methoxy-1,3-benzothiazol-2-amine
  • 6-(Methyloxy)-1,3-benzothiazol-2-amine

Work with 2-Amino-6-methoxybenzothiazole

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-Amino-6-ethoxybenzothiazole94-45-165 % similar Riluzole1744-22-561 % similar 2-Amino-6-bromobenzothiazole15864-32-153 % similar 2-Amino-6-benzothiazolol26278-79-553 % similar 2-Amino-6-fluorobenzothiazole348-40-353 % similar 2-Amino-6-chlorobenzothiazole95-24-953 % similar 6-(Methylsulfonyl)-2-benzothiazolamine17557-67-449 % similar 2-Amino-6-benzothiazolyl thiocyanate7170-77-649 % similar

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

Same formula

2-Mercapto-5-methoxybenzimidazole37052-78-1 5-Methoxy-2-benzothiazolamine54346-87-1 4-Methoxy-2-benzothiazolamine5464-79-9 Benzoylthiourea614-23-3

Elsewhere

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