CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Solid |
|---|---|
| Color/Form | Crystals |
| Boiling Point | 528.5 |
| Melting Point | 231-234 |
| Solubility | 2.90e-01 g/L |
| LogP | 2.68 |
| LogS | -3.1 |
| Stability/Shelf Life | Stable under recommended storage conditions. /Trazadone hydrochloride/ |
| Decomposition | When heated to decomposition it emits toxic fumes of /chlorides, hydrogen chloride and nitrogen oxides/. |
| Ionization Efficiency | Positive |
| Dissociation Constants | 6.79 |
| Kovats Retention Index | 3345 3300 3345 |
| Other Experimental Properties | Highly lipophilic |
COMPUTED DESCRIPTORS
| Molecular Weight | 371.9 g/mol |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 371.1512880 g/mol |
| Monoisotopic Mass | 371.1512880 g/mol |
| Topological Polar Surface Area | 42.4 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 611 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| 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
Trazodone is an N-arylpiperazine in which one nitrogen is substituted by a 3-chlorophenyl group, while the other is substituted by a 3-(3-oxo[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl)propyl group. It has a role as an antidepressant, a sedative, an adrenergic antagonist, a H1-receptor antagonist, a serotonin uptake inhibitor and an anxiolytic drug. It is a N-alkylpiperazine, a N-arylpiperazine, a triazolopyridine and a member of monochlorobenzenes.