chempirical

Oxasulfuron

C17H18N4O6SCAS 144651-06-9406.41 g/mol

Open in Covalent MOL file
NNHONHSOOOOON
EsterEtherSulfonamide

Properties

Molecular formula
C17H18N4O6S
Molar mass
406.41 g/mol
Exact mass
406.0947 Da
Melting point
158 °C (decomposes)
logP
1.17Crippen estimate
Polar surface area
140.1 Ų
H-bond donors / acceptors
2 / 8
Rotatable bonds
5

Identifiers

CAS number
144651-06-9
SMILES
Cc1cc(C)nc(N=C(O)NS(=O)(=O)c2ccccc2C(=O)OC2COC2)n1
InChIKey
IOXAXYHXMLCCJJ-UHFFFAOYSA-N
InChI
InChI=1S/C17H18N4O6S/c1-10-7-11(2)19-16(18-10)20-17(23)21-28(24,25)14-6-4-3-5-13(14)15(22)27-12-8-26-9-12/h3-7,12H,8-9H2,1-2H3,(H2,18,19,20,21,23)

Weigh it out

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

Names and synonyms

4 names
  • Benzoic acid, 2-[[[[(4,6-dimethyl-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]-, 3-oxetanyl ester
  • CGA 277476
  • EP-A 0496701
  • Expert

Work with Oxasulfuron

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

Sulfometuron methyl74222-97-273 % similar Primisulfuron-methyl86209-51-055 % similar Primisulfuron113036-87-651 % similar Chlorimuron-ethyl90982-32-451 % similar Chlorimuron99283-00-849 % similar Mesosulfuron-methyl208465-21-841 % similar Bensulfuron-methyl83055-99-640 % similar Rimsulfuron122931-48-038 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook