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910462-43-0

910462-43-0 Structure

910462-43-0 Structure
IdentificationBack Directory
[Name]

4SC-202 (free base)
[CAS]

910462-43-0
[Synonyms]

CS-1285
Domatinostat
4SC-202 (free base)
(E)-N-(2-aminophenyl)-3-(1-(4-(1-methyl-1H-pyrazol-4-yl)phenylsulfonyl)-1H-pyrrol-3-yl)acrylamide
(2E)-N-(2-Aminophenyl)-3-[1-[[4-(1-methyl-1H-pyrazol-4-yl)phenyl]sulfonyl]-1H-pyrrol-3-yl]-2-propenamide
2-Propenamide, N-(2-aminophenyl)-3-[1-[[4-(1-methyl-1H-pyrazol-4-yl)phenyl]sulfonyl]-1H-pyrrol-3-yl]-, (2E)-
[Molecular Formula]

C23H21N5O3S
[MDL Number]

MFCD28155264
[MOL File]

910462-43-0.mol
[Molecular Weight]

447.51
Chemical PropertiesBack Directory
[density ]

1.34±0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMSO: ≥ 58 mg/mL (129.61 mM)
[form ]

Solid
[pka]

12.60±0.70(Predicted)
[color ]

White to khaki
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
Hazard InformationBack Directory
[Uses]

4SC-202 acts as a selective and potent, orallly available inhibitor of histone deacetylases (HDAC) specific for class 1 HDAC isoenzymes with an IC50 value.
[in vivo]

Oral gavage of Domatinostat (4SC-202 free base) inhibits HT-29 xenograft growth in nude mice, and when combined with oxaliplatin, its activity is further strengthened[2].

[IC 50]

HDAC-3: 0.57 μM (IC50); HDAC-2: 1.12 μM (IC50); HDAC-1: 1.2 μM (IC50); HDAC-11: 9.7 μM (IC50); HDAC-5: 11.3 μM (IC50); HDAC-10: 21 μM (IC50); HDAC-9: 50 μM (IC50)
[storage]

Store at -20°C
Spectrum DetailBack Directory
[Spectrum Detail]

4SC-202 (free base)(910462-43-0)1HNMR
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