CID 657357
Basic information
- CAS
19666-36-5- Standard SMILES
O=c1n(CCCN2CCN(c3cccc(Cl)c3)CC2)nc2ccccn12.[Cl-].[H+]- InChIKey
OHHDIOKRWWOXMT-UHFFFAOYSA-N- Molecular formula
- C19H23Cl2N5O
- Average molar mass
- 408.3 g/mol
- Monoisotopic mass
- 407.1279658
Overview
See also: Trazodone Hydrochloride (preferred); Trazodone (has active moiety).
Names & identifiers
- Preferred name
- CID 657357
- IUPAC
- 2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one;hydron;chloride
- English name
- 2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-1,2,4-triazolo[4,3-a]pyridin-3(2H)-one hydrochloride
- Molecular formula
- C19H23Cl2N5O
- Molecular weight
- 408.32482
Names & synonyms
SCHEMBL120883AKOS026750159Einecs 243-216-22-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-1,2,4-triazolo[4,3-a]pyridin-3(2H)-one hydrochloride
Database identifiers
- CAS
19666-36-5、25332-39-2- PubChem CID
- 657357
Properties
Computed structural properties
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 611
Chemistry & industry
Additional notes
DefinitionChEBI: Trazodone hydrochloride is a hydrochloride salt prepared from equimolar amounts of trazodone and hydrogen chloride. It has a role as a serotonin uptake inhibitor, a H1-receptor antagonist, an adrenergic antagonist, a sedative and an antidepressant. It contains a trazodone.
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