chempirical

Flazasulfuron

C13H12F3N5O5SCAS 104040-78-0407.32 g/mol

Open in Covalent MOL file
OONNHONHSOONFFFN
Alkyl halideEtherSulfonamide

Properties

Molecular formula
C13H12F3N5O5S
Molar mass
407.32 g/mol
Exact mass
407.0511 Da
Melting point
168 °C
logP
1.43Crippen estimate
Polar surface area
135.9 Ų
H-bond donors / acceptors
2 / 8
Rotatable bonds
5

Identifiers

CAS number
104040-78-0
SMILES
COc1cc(OC)nc(N=C(O)NS(=O)(=O)c2ncccc2C(F)(F)F)n1
InChIKey
HWATZEJQIXKWQS-UHFFFAOYSA-N
InChI
InChI=1S/C13H12F3N5O5S/c1-25-8-6-9(26-2)19-11(18-8)20-12(22)21-27(23,24)10-7(13(14,15)16)4-3-5-17-10/h3-6H,1-2H3,(H2,18,19,20,21,22)

Weigh it out

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

Names and synonyms

9 names
  • 2-Pyridinesulfonamide, N-[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]-3-(trifluoromethyl)-
  • N-[[(4,6-Dimethoxy-2-pyrimidinyl)amino]carbonyl]-3-(trifluoromethyl)-2-pyridinesulfonamide
  • SL 160
  • OK 1166
  • Shibagen
  • Katana
  • Chikara
  • 1-(4,6-Dimethoxypyrimidin-2-yl)-3-(3-trifluoromethyl-2-pyridylsulfonyl)urea
  • Shibagen DF

Work with Flazasulfuron

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

Trifloxysulfuron145099-21-470 % similar Rimsulfuron122931-48-067 % similar Nicosulfuron111991-09-465 % similar Sulfosulfuron141776-32-149 % similar Chlorimuron99283-00-847 % similar Ethoxysulfuron126801-58-946 % similar Amidosulfuron120923-37-745 % similar Bensulfuron-methyl83055-99-644 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia