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Chemical structure of Ferrostatin-1 Diyne

GC40211

Ferrostatin-1 Diyne

Also known as ethyl 3-amino-4-(nona-2,4-diynylamino)benzoate

Ferrostatin-1 diyne is a ferroptosis inhibitor and analog of ferrostatin-1

ChemicalCAS2226204-90-4MW298.4FormulaC18H22N2O2
CAS number
2226204-90-4
Molecular weight
298.4
Formula
C18H22N2O2
Solubility
DMF： 30 mg/ml,DMF：PBS (pH 7·2) (1：4)： 0·2 mg/ml,DMSO： 10 mg/ml,Ethanol： 10 mg/ml
InChIKey
OVTPGPSPARHUHG-UHFFFAOYSA-N
Catalogue number
GC40211
Brand
GLPBIO
Computed properties PubChem CID 137700527 · XLogP 4 · TPSA 64.4 Ų · H-bond donors 2
XLogP
4
TPSA
64.4 Ų
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
22

SMILES CCCCC#CC#CCNC1=C(C=C(C=C1)C(=O)OCC)N

Computed descriptors from PubChem (CID 137700527), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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Documents
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