chempirical

Amsacrine

C21H19N3O3SCAS 51264-14-3393.46 g/mol

Open in Covalent MOL file
ONHSOONNH
EtherSulfonamide

Properties

Molecular formula
C21H19N3O3S
Molar mass
393.46 g/mol
Exact mass
393.1147 Da
Melting point
230–240 °C
logP
3.93Crippen estimate
Polar surface area
83.5 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
4

Identifiers

CAS number
51264-14-3
SMILES
COc1cc(NS(C)(=O)=O)ccc1N=c1c2ccccc2[nH]c2ccccc12
InChIKey
XCPGHVQEEXUHNC-UHFFFAOYSA-N
InChI
InChI=1S/C21H19N3O3S/c1-27-20-13-14(24-28(2,25)26)11-12-19(20)23-21-15-7-3-5-9-17(15)22-18-10-6-4-8-16(18)21/h3-13,24H,1-2H3,(H,22,23)

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Names and synonyms

19 names · show all
  • Methanesulfonamide, N-[4-(9-acridinylamino)-3-methoxyphenyl]-
  • N-[4-(9-Acridinylamino)-3-methoxyphenyl]methanesulfonamide
  • 4′-(9-Acridinylamino)methanesulfon-m-anisidide
  • NSC 249992
  • AMSA
  • Acridinylanisidide
  • NSC 156303
  • Amsidine
  • m-Amsacrine
  • m-AMSA
  • SN 21429
  • Amsidil
  • Amsidyl
  • CI 880
  • SN 11841
  • Lamasine
  • Amekrin
  • Amsalyo
  • PH 006888

Work with Amsacrine

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-Phenylmethanesulfonamide1197-22-438 % similar 5-Methylsulfonaminoindole-2-carboxylic acid150975-95-435 % similar N-(4-(2-Aminoacetyl)-5-methoxy-2-phenoxyphenyl)methanesulfonamide hydrochloride149436-41-932 % similar 4-Methoxy-1H-indole-2-carboxylic acid103260-65-731 % similar Methyl 4-methoxy-1H-indole-2-carboxylate111258-23-231 % similar N-[3-(Dipropylamino)phenyl]methanesulfonamide186453-43-031 % similar [4-(Methylsulfonamido)phenyl]boronic acid380430-57-931 % similar Iguratimod123663-49-031 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook