chempirical

Metamitron

C10H10N4OCAS 41394-05-2202.22 g/mol

Open in Covalent MOL file
NNONH2N
Primary amine

Properties

Molecular formula
C10H10N4O
Molar mass
202.22 g/mol
Exact mass
202.0855 Da
Density
0.6 g/mL
Melting point
167 °C
logP
0.33Crippen estimate
Polar surface area
73.8 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
1

Identifiers

CAS number
41394-05-2
SMILES
Cc1nnc(-c2ccccc2)c(=O)n1N
InChIKey
VHCNQEUWZYOAEV-UHFFFAOYSA-N
InChI
InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3

Weigh it out

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

Names and synonyms

18 names · show all
  • 1,2,4-Triazin-5(4H)-one, 4-amino-3-methyl-6-phenyl-
  • 4-Amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one
  • 3-Methyl-4-amino-6-phenyl-1,2,4-triazin-5-one
  • BAY 6676
  • 4-Amino-3-methyl-6-phenyl-1,2,4-triazin-5-one
  • DRW 1139
  • Goltix
  • BAY-DRW 1139
  • Goltix WG 70
  • Metron stefes
  • Goltix VM 90
  • Goltix WG
  • Burakomitron
  • Goltix compact
  • Gladiator
  • Goltix top
  • Metron 700SL
  • Metafol 700SC

Work with Metamitron

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-Amino-3,5-dimethyl-1,2,4-triazole3530-15-244 % similar 2-Methyl-4,5-diphenylthiazole3755-83-733 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook