chempirical

Ziprasidone hydrochloride

C21H22Cl2N4OSCAS 122883-93-6449.39 g/mol

Open in Covalent MOL file
HClOHNClNNNS
Aryl halideTertiary amine

Properties

Molecular formula
C21H22Cl2N4OS
Molar mass
449.39 g/mol
Exact mass
448.0891 Da
Melting point
above 300 °C
logP
4.88Crippen estimate
Polar surface area
52.0 Ų
H-bond donors / acceptors
1 / 5
Rotatable bonds
4

Identifiers

CAS number
122883-93-6
SMILES
Cl.OC1=Nc2cc(Cl)c(CCN3CCN(c4nsc5ccccc45)CC3)cc2C1
InChIKey
NZDBKBRIBJLNNT-UHFFFAOYSA-N
InChI
InChI=1S/C21H21ClN4OS.ClH/c22-17-13-18-15(12-20(27)23-18)11-14(17)5-6-25-7-9-26(10-8-25)21-16-3-1-2-4-19(16)28-24-21;/h1-4,11,13H,5-10,12H2,(H,23,27);1H

Weigh it out

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

Names and synonyms

7 names
  • 2H-Indol-2-one, 5-[2-[4-(1,2-benzisothiazol-3-yl)-1-piperazinyl]ethyl]-6-chloro-1,3-dihydro-, hydrochloride (1:1)
  • 2H-Indol-2-one, 5-[2-[4-(1,2-benzisothiazol-3-yl)-1-piperazinyl]ethyl]-6-chloro-1,3-dihydro-, monohydrochloride
  • CP 88059-1
  • 5-[2-[4-(1,2-Benzisothiazol-3-yl)-1-piperazinyl)ethyl]-6-chloro-1,3-dihydro-2H-indol-2-one hydrochloride
  • Zeldox
  • Zipsydon
  • Azona

Work with Ziprasidone 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

Ziprasidone monohydrochloride monohydrate138982-67-995 % similar Ziprasidone146939-27-795 % similar Ziprasidone mesylate hydrate199191-69-076 % similar 5-(2-Chloroethyl)-6-chlorooxindole118289-55-745 % similar Sm 9018129273-38-744 % similar 3-(1-Piperazinyl)-1,2-benzisothiazole hydrochloride144010-02-644 % similar 3-Piperazin-1-yl-benzo[D]isothiazole hydrochloride87691-88-144 % similar Lurasidone hydrochloride367514-88-339 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook