Meloxicam-D3

C₁₄H₁₀D₃N₃O₄S₂CAS 942047-63-4354.41 g/mol

Open in Covalent MOL file

Alkene Amide Sulfonamide

Properties

Molecular formula: C₁₄H₁₀D₃N₃O₄S₂
Molar mass: 354.41 g/mol
Exact mass: 354.0536 Da
logP: 1.95Crippen estimate
Polar surface area: 99.6 Å²
H-bond donors / acceptors: 2 / 6
Rotatable bonds: 2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

942047-63-4

SMILES

[2H]C([2H])([2H])N1C(=C(C2=CC=CC=C2S1(=O)=O)O)C(=O)NC3=NC=C(S3)C

InChIKey

ZRVUJXDFFKFLMG-BMSJAHLVSA-N

InChI

InChI=1S/C14H13N3O4S2/c1-8-7-15-14(22-8)16-13(19)11-12(18)9-5-3-4-6-10(9)23(20,21)17(11)2/h3-7,18H,1-2H3,(H,15,16,19)/i2D3

Weigh it out

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

Work with Meloxicam-D3

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Meloxicam71125-38-7Unlabelled

Similar compounds

2-Methyl-4-hydroxy-2H-1,2-benzothiazine-3-carboxylic acid methyl ester 1,1-dioxide35511-15-039 % similar Piroxicam36322-90-439 % similar 4-Hydroxy-2-methyl-2H-1,2-benzothiazine-3-carboxylic acid ethylester 1,1-dioxide24683-26-938 % similar 2-Methyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide15448-99-431 % similar 4-Hydroxy-2H-1,2-benzothiazine-3-carboxylic acid methyl ester 1,1-dioxide35511-14-930 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook