Compound 7P

C₂₂H₂₃N₃O₅SCAS 1890208-58-8441.50 g/mol

Open in Covalent MOL file

Amide Ether Sulfonamide

Properties

Molecular formula: C₂₂H₂₃N₃O₅S
Molar mass: 441.50 g/mol
Exact mass: 441.1358 Da
logP: 3.24Crippen estimate
Polar surface area: 97.8 Å²
H-bond donors / acceptors: 1 / 6
Rotatable bonds: 8

Identifiers

CAS number

1890208-58-8

SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=C(C=CN=C2)OC)C3=CC=CC=C3OC

InChIKey

NAXWKPFXCOBXLE-UHFFFAOYSA-N

InChI

InChI=1S/C22H23N3O5S/c1-16-8-10-17(11-9-16)31(27,28)25(19-6-4-5-7-21(19)30-3)15-22(26)24-18-14-23-13-12-20(18)29-2/h4-14H,15H2,1-3H3,(H,24,26)

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Names and synonyms

1 names

2-((N-(2-Methoxyphenyl)-4-methylphenyl)sulfonamido)-N-(4-methoxypyridin-3-yl)acetamide

Work with Compound 7P

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

N-(2-Methoxyphenyl)maleimide17392-68-631 % similar 1-[(4-Methylphenyl)sulfonyl]piperazine27106-51-031 % similar N,N-Bis(2-chloroethyl)-4-methylbenzenesulfonamide42137-88-231 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook