4-Amino-N-(furan-2-ylmethyl)benzene-1-sulfonamide

C₁₁H₁₂N₂O₃SCAS 5626-92-6252.29 g/mol

Open in Covalent MOL file

Primary amine Sulfonamide

Properties

Molecular formula: C₁₁H₁₂N₂O₃S
Molar mass: 252.29 g/mol
Exact mass: 252.0569 Da
logP: 1.34Crippen estimate
Polar surface area: 85.3 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 4

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

5626-92-6

SMILES

C1=COC(=C1)CNS(=O)(=O)C2=CC=C(C=C2)N

InChIKey

GDZYTNDTKOAWSN-UHFFFAOYSA-N

InChI

InChI=1S/C11H12N2O3S/c12-9-3-5-11(6-4-9)17(14,15)13-8-10-2-1-7-16-10/h1-7,13H,8,12H2

Weigh it out

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

Names and synonyms

1 names

4-Amino-N-furan-2-ylmethyl-benzenesulfonamide

Work with 4-Amino-N-(furan-2-ylmethyl)benzene-1-sulfonamide

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

4-Amino-N-ethylbenzenesulfonamide1709-53-154 % similar 4,4′-Diaminobenzenesulfonanilide16803-97-750 % similar Sulfadiazine68-35-947 % similar Sulfapyridine144-83-244 % similar 4-Amino-N-5-isoxazolylbenzenesulfonamide7758-79-444 % similar Sulfamethazine57-68-143 % similar N-(4-Aminophenyl)-4-methylbenzenesulfonamide6380-08-143 % similar Sulfamethoxazole723-46-641 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook