Olanzapine-d3 - ≥98 atom% D,≥98% , CAS No.786686-79-1

CAS: 786686-79-1 Cat. No.: O334345 Summenformel: C₁₇H₁₇D₃N₄S Molekulargewicht: 315.45 EG-Nummer: 695-180-6

GRADE & PURITY ≥98 atom% D,≥98%

Synonyms

SCHEMBL3058260 | 2-methyl-4-[4-(trideuteriomethyl)piperazin-1-yl]-10H-thieno[2,3-b][1,5]benzodiazepine | 2-Methyl-4-[4-(~2~H_3_)methylpiperazin-1-yl]-5H-thieno[2,3-b][1,5]benzodiazepine | AKOS037645326 | Olanzapine-methyl-d3 | HY-14541S | Integrol-d3 | AK

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Übersicht

Olanzapine-methyl-d3 is a deuterated Olanzapine, a serotonin (5-HT2) and dopamine (D1/D2) receptor antagonist with anti-cholinergic activity.

Specifications

Synonyme

SCHEMBL3058260 | 2-methyl-4-[4-(trideuteriomethyl)piperazin-1-yl]-10H-thieno[2,3-b][1,5]benzodiazepine | 2-Methyl-4-[4-(~2~H_3_)methylpiperazin-1-yl]-5H-thieno[2,3-b][1,5]benzodiazepine | AKOS037645326 | Olanzapine-methyl-d3 | HY-14541S | Integrol-d3 | AK

Spezifikationen & Reinheit

≥98 atom% D,≥98%

Storage

Store at -20°C

Verschickt in

Ice chest + Ice pads

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Aktionsart

ACTIVATOR

Reinheit

≥98 atom% D,≥98%

Namen und Kennungen

• Pubchem Sid: 528771334
• Kanonisches Lächeln: CC1=CC2=C(S1)NC3=CC=CC=C3N=C2N4CCN(CC4)C
• IUPAC Name: 2-methyl-4-[4-(trideuteriomethyl)piperazin-1-yl]-10H-thieno[2,3-b][1,5]benzodiazepine
• InChIKey: KVWDHTXUZHCGIO-BMSJAHLVSA-N
• INCHI: 1S/C17H20N4S/c1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12/h3-6,11,19H,7-10H2,1-2H3/i2D3
• Isomere SMILES: [2H]C([2H])([2H])N1CCN(CC1)C2=NC3=CC=CC=C3NC4=C2C=C(S4)C
• Alternative CAS-Nummer: 132539-06-1（unlabelled）
• Molekulargewicht: 315.45
• Reaxy-Rn: 7655141
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7655141&ln=

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in Chloroform, Dichloromethane and Ethyl Acetate
• Schmelzpunkt (°C): 188-190° C
• Molekulargewicht: 315.500 g/mol
• XLogP3: 2.900
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 315.16 Da
• Monoisotopic Mass: 315.16 Da
• Topological Polar Surface Area: 59.100 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 432.000
• Isotope Atom Count: 3
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Referenzen

1. Xiuquan Jia, Jiping Ma, Min Wang, Zhongtian Du, Fang Lu, Feng Wang, Jie Xu.  (2014)  Promoted role of Cu(NO3)2 on aerobic oxidation of 5-hydroxymethylfurfural to 2,5-diformylfuran over VOSO4.  APPLIED CATALYSIS A-GENERAL,      [PMID:] [10.1016/j.apcata.2014.05.031]