Zoniporide mesylate structure

Zoniporide mesylate

5-cyclopropyl-N-(diaminomethylidene)-1-quinolin-5-ylpyrazole-4-carboxamide;methanesulfonic acid

Also Known As: Zoniporide mesylate|Zoniporide mesilate|Zoniporide mesylate [USAN]|Zoniporide mesylate (INN/USAN)|CP-597,396-27|CP-597396-27|N-Carbamimidoyl-5-cyclopropyl-1-(quinolin-5-yl)-1H-pyrazole-4-carboxamide methanesulfonate|1H-PYRAZOLE-4-CARBOXAMIDE, N-(AMINOIMINOMETHYL)-5-CYCLOPROPYL-1-(5-QUINOLINYL)-, METHANESULFONATE (1:1)|1H-PYRAZOLE-4-CARBOXAMIDE, N-(AMINOIMINOMETHYL)-5-CYCLOPROPYL-1-(5-QUINOLINYL)-, MONOMETHANESULFONATE|1H-Pyrazole-4-carboxamide, N-(aminoiminomethyl)-5-cyclopropyl-1-(5-quinolinyl)-,monomethanesulfonate|5-cyclopropyl-N-(diaminomethylidene)-1-quinolin-5-yl-pyrazole-4-carboxamide; Methanesulfonic Acid|Methanesulfonic acid--5-cyclopropyl-N-(diaminomethylidene)-1-(quinolin-5-yl)-1H-pyrazole-4-carboxamide (1/1)

CAS: 249296-45-5
Molecular Formula C18H20N6O4S
Molecular Weight 416.12668 g/mol
LogP 1.2155
Topological Polar Surface Area 166.55 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 5
Rotatable Bonds 3
Exact Mass 416.12668
Monoisotopic Mass 416.12668
Heavy Atoms 29
Complexity 1180.7866

Chemical Identifiers

CAS Number 249296-45-5
SMILES CS(=O)(=O)O.C1CC1C2=C(C=NN2C3=CC=CC4=C3C=CC=N4)C(=O)N=C(N)N

Product Overview

Zoniporide mesylate (CAS 249296-45-5), with molecular formula C18H20N6O4S and molecular weight 416.12668 g/mol. IUPAC: 5-cyclopropyl-N-(diaminomethylidene)-1-quinolin-5-ylpyrazole-4-carboxamide;methanesulfonic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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