EPS002

MS-275

A HDAC1 and HDAC3 inhibitor

• Synonym(e): MS-275 (Entinostat, SNDX-275), 3-pyridinylmethyl [[4-[[(2-aminophenyl)amino]carbonyl]phenyl]methyl]carbamate, N-(2-Aminophenyl)-4-[N-(pyridine-3ylmethoxycarbonyl)aminomethyl]benzamide
• Empirische Formel (Hill-System): C₂₁H₂₀N₄O₃
• CAS-Nummer: 209783-80-2
• Molekulargewicht: 376.41
• NACRES: NA.41
• PubChem Substance ID: 329799578
• UNSPSC Code: 12352200
• MDL number: MFCD03453552
• Assay: ≥99%

Eigenschaften

• assay: ≥99%
• solubility: DMSO: 38 mg/mL
• storage temp.: −20°C
• SMILES string: Nc1ccccc1NC(=O)c2ccc(CNC(=O)OCc3cccnc3)cc2
• InChI: 1S/C21H20N4O3/c22-18-5-1-2-6-19(18)25-20(26)17-9-7-15(8-10-17)13-24-21(27)28-14-16-4-3-11-23-12-16/h1-12H,13-14,22H2,(H,24,27)(H,25,26)
• InChI key: INVTYAOGFAGBOE-UHFFFAOYSA-N
• Gene Information: human ... HDAC1(3065), HDAC10(83933), HDAC11(79885), HDAC2(3066), HDAC3(8841), HDAC4(9759), HDAC5(10014), HDAC6(10013), HDAC7(51564), HDAC8(55869), HDAC9(9734)

Beschreibung

General description

Preferentially inhibits HDAC1 (IC₅₀=300 nM) over HDAC3 (IC₅₀=8 μM). Has no inhibitory activity towards HDAC8 (IC₅₀>100 μM).

Application

MS-275 has been used as a histone deacetylase-1 inhibitor.

Biochem/physiol Actions

HDAC inhibitor; antiproliferative.

Sicherheitshinweise

• pictograms: GHS06,GHS08
• signalword: Danger
• hcodes: H301,H360
• pcodes: P202 - P264 - P280 - P301 + P310 - P405 - P501
• Hazard Classifications: Acute Tox. 3 Oral - Repr. 1A
• Lagerklasse: 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