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About This Item
Empirical Formula (Hill Notation):
C23H25N3O3SHCl
CAS Number:
Molecular Weight:
459.99
NACRES:
NA.77
PubChem Substance ID:
UNSPSC Code:
41106300
MDL number:
InChI key
YWMAVHIKOAOSFM-UHFFFAOYSA-N
SMILES string
Cl[H].COc1ccc(cc1)-c2nc(sc2-c3ccc(OC)cc3)C(=O)N4CCN(C)CC4
InChI
1S/C23H25N3O3S.ClH/c1-25-12-14-26(15-13-25)23(27)22-24-20(16-4-8-18(28-2)9-5-16)21(30-22)17-6-10-19(29-3)11-7-17;/h4-11H,12-15H2,1-3H3;1H
biological source
synthetic (organic)
assay
≥98% (HPLC)
form
powder
color
faintly yellow
solubility
methylene chloride: 50 mg/mL, slightly hazy, yellow
shipped in
wet ice
storage temp.
2-8°C
Quality Level
Related Categories
Biochem/physiol Actions
Selective cyclooxgenase-1 (COX-1) inhibitor.
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type N95 (US)
Regulatory Information
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