O111

Octoclothepin maleate salt

solid

• Synonym(s): 1-(8-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)-4-methyl-piperazine maleate salt
• Empirical Formula (Hill Notation): C₁₉H₂₁ClN₂S · C₄H₄O₄
• CAS Number: 4789-68-8
• Molecular Weight: 460.97
• NACRES: NA.77
• PubChem Substance ID: 24277921
• UNSPSC Code: 12352200
• MDL number: MFCD00153855
• Form: solid

Properties

• form: solid
• Quality Segment: 200
• color: white
• solubility: 45% (w/v) aq 2-hydroxypropyl-β-cyclodextrin: >21 mg/mL
• SMILES string: [H]\C(=C(/[H])C(O)=O)C(O)=O.CN1CCN(CC1)C2Cc3ccccc3Sc4ccc(Cl)cc24
• InChI: 1S/C19H21ClN2S.C4H4O4/c1-21-8-10-22(11-9-21)17-12-14-4-2-3-5-18(14)23-19-7-6-15(20)13-16(17)19;5-3(6)1-2-4(7)8/h2-7,13,17H,8-12H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
• InChI key: GWKBZIADWSOIQV-BTJKTKAUSA-N
• Gene Information: human ... DRD2(1813), HTR2A(3356), HTR2B(3357), HTR2C(3358)

Description

Biochem/physiol Actions

D₂ dopamine receptor antagonist; 5-HT₂ serotonin receptor antagonist.

Safety Information

• pictograms: GHS06
• signalword: Danger
• hcodes: H301
• pcodes: P301 + P310
• Hazard Classifications: Acute Tox. 3 Oral
• Storage Class: 6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
• wgk: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable
• ppe: Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges