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Chemical structure of LSD1/HDAC6-IN-2

GC74062

LSD1/HDAC6-IN-2

Also known as N-hydroxy-4-[[4-[[[(1R,2S)-2-phenylcyclopropyl]amino]methyl]pyrazol-1-yl]methyl]benzamide;hydrobromide

LSD1/HDAC6-IN-2 (JBI-802) is an orally active LSD1/HDAC6/MAO-A inhibitor, with IC50 values of 5 nM, 11 nM, and 5 nM, respectively

ChemicalCAS2982787-50-6MW443.34FormulaC21H23BrN4O2
CAS number
2982787-50-6
Molecular weight
443.34
Formula
C21H23BrN4O2
Solubility
DMSO ： ≥ 100 mg/mL (225·56 mM)
InChIKey
VYVGGNXALTUECS-CMXBXVFLSA-N
Catalogue number
GC74062
Brand
GLPBIO
Computed properties PubChem CID 166177211 · TPSA 79.2 Ų · H-bond donors 4 · H-bond acceptors 4
TPSA
79.2 Ų
H-bond donors
4
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
28

SMILES C1[C@H]([C@@H]1NCC2=CN(N=C2)CC3=CC=C(C=C3)C(=O)NO)C4=CC=CC=C4.Br

Computed descriptors from PubChem (CID 166177211), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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