CHEMICAL AND PHYSICAL PROPERTIES
| Melting Point | Molecular weight: 244.79; white to off-white crystalline powder; melting point range: 201-203 °C; freely soluble in alcohol and chloroform; very soluble in water; virtually insoluble in ether; pH 4.6-5.6 for a 1% aqueous solution /Cevimeline hydrochloride/ |
|---|---|
| Solubility | In water, 4.1X10+4 mg/L at 25 °C /Estimated/ |
| LogP | log Kow = 1.22 /Estimated/ |
| Henry's Law Constant | Henry's Law constant =1.6X10-9 atm-cu m/mole @ 25 °C /Estimated/ |
| Dissociation Constants | pKa= 9.78 /Estimated/ |
| Other Experimental Properties | Hydroxyl radical reaction rate constant = 1.5X10-10 cu cm/molec-sec @ 25 °C /Estimated/ |
COMPUTED DESCRIPTORS
| Molecular Weight | 199.32 g/mol |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 0 |
| Exact Mass | 199.10308534 g/mol |
| Monoisotopic Mass | 199.10308534 g/mol |
| Topological Polar Surface Area | 37.8 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 215 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Cevimeline is an orally available cholinergic agonist that is used to treat symptoms of dry mouth in patients with keratoconjunctivitis sicca (Sjögren syndrome). Cevimeline has not been linked to serum enzyme elevations during therapy or to instances of clinically apparent liver injury.