W-7 Hydrochloride

C16H22Cl2N2O2SCAS 61714-27-0377.32 g/mol

Open in Covalent MOL file
HClH2NHNSOOCl
Aryl halidePrimary amineSulfonamide

Properties

Molecular formula
C16H22Cl2N2O2S
Molar mass
377.32 g/mol
Exact mass
376.0779 Da
Melting point
214 °C
logP
3.71Crippen estimate
Polar surface area
72.2 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
8

Hazards

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

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Identifiers

CAS number
61714-27-0
SMILES
Cl.NCCCCCCNS(=O)(=O)c1cccc2c(Cl)cccc12
InChIKey
OMMOSRLIFSCDBL-UHFFFAOYSA-N
InChI
InChI=1S/C16H21ClN2O2S.ClH/c17-15-9-5-8-14-13(15)7-6-10-16(14)22(20,21)19-12-4-2-1-3-11-18;/h5-10,19H,1-4,11-12,18H2;1H

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Names and synonyms

4 names
  • 1-Naphthalenesulfonamide, N-(6-aminohexyl)-5-chloro-, hydrochloride (1:1)
  • 1-Naphthalenesulfonamide, N-(6-aminohexyl)-5-chloro-, monohydrochloride
  • W 7
  • NSC 683545

Work with W-7 Hydrochloride

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-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide hydrochloride88519-57-764 % similar N-(4-Aminobutyl)-2-naphthalenesulfonamide hydrochloride89108-46-351 % similar H-9 Dihydrochloride116700-36-850 % similar H 8 Dihydrochloride113276-94-139 % similar EDANS50402-56-737 % similar Hydrochlorothiazide58-93-534 % similar 2,3-Dichlorophenylhydrazine hydrochloride21938-47-633 % similar Dansylhydrazine33008-06-933 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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