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Chemical structure of Slingshot inhibitor D3

GC62117

Slingshot inhibitor D3

Also known as 4-[[4-[(Z)-[3-(2-methylphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]phenoxy]methyl]benzoic acid

Slingshot inhibitor D3 is a potent, selective, reversible and competitive inhibitor of Slingshot

ChemicalCAS1715076-35-9MW461.55FormulaC25H19NO4S2
CAS number
1715076-35-9
Molecular weight
461.55
Formula
C25H19NO4S2
Solubility
DMSO : 25 mg/mL (54·17 mM; ultrasonic and warming and heat to 60°C)
InChIKey
JZFBPGPPIJBVMI-HMAPJEAMSA-N
Catalogue number
GC62117
Brand
GLPBIO
Computed properties PubChem CID 154724053 · XLogP 5.9 · TPSA 124 Ų · H-bond donors 1
XLogP
5.9
TPSA
124 Ų
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
32

SMILES CC1=CC=CC=C1N2C(=O)/C(=C/C3=CC=C(C=C3)OCC4=CC=C(C=C4)C(=O)O)/SC2=S

Computed descriptors from PubChem (CID 154724053), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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