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Trazodone

CAT: 0931-T22442-04Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T22442-04Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
19794-93-5
Target
Adrenergic Receptor, Serotonin Transporter, Histamine Receptor, 5-HT Receptor
Related Pathways
Neuroscience, GPCR/G Protein, Immunology/Inflammation
Purity
0.9992
Bioactivity
Trazodone (AF-1161), a 5-HT 2A/2C receptor antagonist, is used as an antidepressant for treating major anxiety disorders and depressive disorder.
Smiles
O=C1N2C(=NN1CCCN3CCN(CC3)C4=CC(Cl)=CC=C4)C=CC=C2
Molecular Formula
C19H22ClN5O
Molecular Weight
371.86
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Trazodone

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, an anxiolytic drug, a sedative, an adrenergic antagonist, a H1-receptor antagonist and a serotonin uptake inhibitor. It is a triazolopyridine, a N-alkylpiperazine, a N-arylpiperazine and a member of monochlorobenzenes.

CAS Number19794-93-5
PubChem CID5533
IUPAC Name2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one
Molecular FormulaC19H22ClN5O
Molecular Weight371.9
XLogP2.8
Topological Polar Surface Area42.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count26
Formal Charge0
Complexity611
SMILES
C1CN(CCN1CCCN2C(=O)N3C=CC=CC3=N2)C4=CC(=CC=C4)Cl
InChI
InChI=1S/C19H22ClN5O/c20-16-5-3-6-17(15-16)23-13-11-22(12-14-23)8-4-10-25-19(26)24-9-2-1-7-18(24)21-25/h1-3,5-7,9,15H,4,8,10-14H2
InChIKey
PHLBKPHSAVXXEF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Trazodone
CAS: 19794-93-5
CID: 5533
Formula: C19H22ClN5O
MW: 371.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight371.9
XLogP32.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass371.1512880
Monoisotopic Mass371.1512880
Topological Polar Surface Area42.4 Ų
Heavy Atom Count26
Formal Charge0
Complexity611
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes