Olanzapine-d3
Basic information
- CAS
786686-79-1- Standard SMILES
[2H]C([2H])([2H])N1CCN(C2=Nc3ccccc3Nc3sc(C)cc32)CC1- InChIKey
KVWDHTXUZHCGIO-UHFFFAOYSA-N- Molecular formula
- C17H20N4S
- Average molar mass
- 315.5 g/mol
- Monoisotopic mass
- 315.15969807
Overview
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Names & identifiers
- Preferred name
- Olanzapine-d3
- IUPAC
- 2-methyl-4-[4-(trideuteriomethyl)piperazin-1-yl]-10H-thieno[2,3-b][1,5]benzodiazepine
- English name
- Olanzapine-methyl-d3
- Molecular formula
- C17H20N4S
- Molecular weight
- 312.44
Names & synonyms
Olanzapine-d3786686-79-1Olanzapine-methyl-d3Olanzapine D3MFCD080634792-methyl-4-[4-(trideuteriomethyl)piperazin-1-yl]-10H-thieno[2,3-b][1,5]benzodiazepineOlanzapine-d3 (4-methyl-d3-piperazinyl)Olanzapine-d3 (1.0mg/ml in Acetonitrile)2-methyl-4-[4-(trideuteriomethyl)piperazin-1-yl]-5H-thieno[3,2-c][1,5]benzodiazepineorb1992746SCHEMBL3058260SCHEMBL31663898
Show more names
Oltal-d3Oliza-d3Oleanz-d3Lanzac-d3Zyprexa-d3Integrol-d3LY 170053-d3D3-Olanzapine[2H3]-Olanzapine
DTXSID80662160ARD10167D3HY-14541SAKOS030242791AKOS037645326AS-6016Olanzapine-d3 (1 mg/ml in Acetonitrile)Olanzapine-D3 1.0 mg/ml in Acetonitrile
Database identifiers
- CAS
786686-79-1- PubChem CID
- 136102015
- DTXSID
DTXSID80662160- Nikkaji
- J2.080.989B
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 59.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 432
Physicochemical properties
- Melting point
- 188 · 188-190°C
- storage temp.
- -20 °C · -20°C Freezer
- solubility
- Chloroform (Slightly), Methanol (Slightly, Heated)
- form
- Solid
- color
- Yellow to Brown
- Symbol(GHS)
- 7 · GHS07,GHS06
- Signal word
- Danger
- Hazard statements
- 319 · H319-H301-H317
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P270-P301+P310-P321-P330-P405-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS06
- Hazard statements
- H319-H301-H317
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P270-P301+P310-P321-P330-P405-P501
Chemistry & industry
Applications
UsesDeuterated Olanzapine, a serotonin (5-HT2) and dopamine (D1/D2) receptor antagonist with anticholinergic activity. Antipsychotic.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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