chempirical

1H-Thieno[2,3-C][1,2]thiazin-4(3H)-one, 1,5,6-trimethyl-, 2,2-dioxide

C9H11NO3S2CAS 175202-79-6245.31 g/mol

Open in Covalent MOL file
SOSOON
KetoneSulfonamide

Properties

Molecular formula
C9H11NO3S2
Molar mass
245.31 g/mol
Exact mass
245.0180 Da
logP
1.33Crippen estimate
Polar surface area
54.5 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
0

Identifiers

CAS number
175202-79-6
SMILES
Cc1sc2c(c1C)C(=O)CS(=O)(=O)N2C
InChIKey
LXRNFMSHWRSCAY-UHFFFAOYSA-N
InChI
InChI=1S/C9H11NO3S2/c1-5-6(2)14-9-8(5)7(11)4-15(12,13)10(9)3/h4H2,1-3H3

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

Work with 1H-Thieno[2,3-C][1,2]thiazin-4(3H)-one, 1,5,6-trimethyl-, 2,2-dioxide

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

Ethyl 2-amino-4,5-dimethylthiophene-3-carboxylate4815-24-131 % similar

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

Elsewhere

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