CHEMICAL AND PHYSICAL PROPERTIES
Color/Form | Crystals from methanol |
---|---|
Odor | Odorless |
Taste | Tasteless |
Melting Point | 178-179 °C |
Solubility | insoluble in water |
Stability/Shelf Life | DECOMP SLOWLY IN LIGHT; RELATIVELY STABLE IN HEAT. /PAMOATE/ |
Collision Cross Section | 143 Ų [M+H]+ [CCS Type: TW] |
COMPUTED DESCRIPTORS
Molecular Weight | 206.31 g/mol |
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XLogP3 | 1.6 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 2 |
Exact Mass | 206.08776963 g/mol |
Monoisotopic Mass | 206.08776963 g/mol |
Topological Polar Surface Area | 43.8 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 248 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Pyrantel is a carboxamidine that is 1,4,5,6-tetrahydropyrimidine that is substituted at position 1 by a methyl group and at position 2 by an (E)-2-(2-thienyl)vinyl group. It is used, particularly as the embonate [4,4'-methylenebis(3-hydroxy-2-naphthoate)] salt, as an anthelmintic that is effective against intestinal nematodes including threadworms, roundworms and hookworms, and is included in the WHO 'Model List of Essential Medicines'. It has a role as an antinematodal drug. It is a member of thiophenes, a carboxamidine and a member of 1,4,5,6-tetrahydropyrimidines.