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Chemical structure of ML355

GC36628

ML355

Also known as N-(1,3-benzothiazol-2-yl)-4-[(2-hydroxy-3-methoxyphenyl)methylamino]benzenesulfonamide

ML355 is a potent and selective inhibitor of 12-Lipoxygenase (12-LOX) with an IC50 of 0·34 μM, shows excellent selectivity over related lipoxygenases and cyclooxygenases, and possesses favorable ADME properties

ChemicalCAS1532593-30-8MW441.52FormulaC21H19N3O4S2
CAS number
1532593-30-8
Molecular weight
441.52
Formula
C21H19N3O4S2
Solubility
DMSO： ≥ 42 mg/mL (95·13 mM)
InChIKey
OWHBVKBNNRYMIN-UHFFFAOYSA-N
Catalogue number
GC36628
Brand
GLPBIO
Computed properties PubChem CID 70701426 · XLogP 4.3 · TPSA 137 Ų · H-bond donors 3
XLogP
4.3
TPSA
137 Ų
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
30

SMILES COC1=CC=CC(=C1O)CNC2=CC=C(C=C2)S(=O)(=O)NC3=NC4=CC=CC=C4S3

Computed descriptors from PubChem (CID 70701426), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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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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