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Mirtazapine

CAT: 0572-TRC-M365000-25MGSize: 25 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-M365000-25MGSize:25 mg
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CAS Number
85650-52-8
Synonyms
1,2,3,4,10,14b-Hexahydro-2-methylpyrazino[2,1-a]pyrido[2,3-c][2]benzazepine; (+/-)-1,2,3,4,10,14b-Hexahydro-2-methylpyrazino[2,1-a]pyrido[2,3-c][2]benzazepine; 6-Azamianserin; Mepirzapin; Mepirzepine; Mirtazapine; Mirtazepine; Mirtazipine; Org 3770; Promyrtil; Remergil; Remergon; Remeron; Rexer; Zispin
Hazard Statement
Harmful if swallowed; UN number: UN3077; Packing Group: III
Purity
>95% (HPLC)
Smiles
CN1CCN2C(C1)c3ccccc3Cc4cccnc24
Molecular Formula
C17 H19 N3
Molecular Weight
265.35
InChI
InChI=1S/C17H19N3/c1-19-9-10-20-16(12-19)15-7-3-2-5-13(15)11-14-6-4-8-18-17(14)20/h2-8,16H,9-12H2,1H3
Additionnal Information
IUPAC name: 1,2,3,4,10,14b-Hexahydro-2-methylpyrazino[2,1-a]pyrido[2,3-c][2]benzazepine
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Mirtazapine

Mirtazapine is a benzazepine and a tetracyclic antidepressant. It has a role as a oneirogen, an anxiolytic drug, an alpha-adrenergic antagonist, a H1-receptor antagonist, a histamine antagonist and a serotonergic antagonist.

CAS Number85650-52-8
PubChem CID4205
IUPAC Name5-methyl-2,5,19-triazatetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),8,10,12,16,18-hexaene
Molecular FormulaC17H19N3
Molecular Weight265.35
XLogP3.3
Topological Polar Surface Area19.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count20
Formal Charge0
Complexity345
SMILES
CN1CCN2C(C1)C3=CC=CC=C3CC4=C2N=CC=C4
InChI
InChI=1S/C17H19N3/c1-19-9-10-20-16(12-19)15-7-3-2-5-13(15)11-14-6-4-8-18-17(14)20/h2-8,16H,9-12H2,1H3
InChIKey
RONZAEMNMFQXRA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Mirtazapine
CAS: 85650-52-8
CID: 4205
Formula: C17H19N3
MW: 265.35
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight265.35
XLogP33.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass265.157897619
Monoisotopic Mass265.157897619
Topological Polar Surface Area19.4 Ų
Heavy Atom Count20
Formal Charge0
Complexity345
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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