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Chemical structure of AKOS B018304

GC30756

AKOS B018304

Also known as (5Z)-5-[(2-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

AKOS B018304 is an arylalkylidene derivative, with polar substitution at para-position

ChemicalCAS6308-22-1MW266.3FormulaC10H6N2O3S2
CAS number
6308-22-1
Molecular weight
266.3
Formula
C10H6N2O3S2
Solubility
DMSO : ≥ 77·5 mg/mL (291·03 mM)
InChIKey
CTTRUEBEEFZQBL-YVMONPNESA-N
Catalogue number
GC30756
Brand
GLPBIO
Computed properties PubChem CID 1380749 · XLogP 2.6 · TPSA 132 Ų · H-bond donors 1
XLogP
2.6
TPSA
132 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
17

SMILES C1=CC=C(C(=C1)/C=C\2/C(=O)NC(=S)S2)[N+](=O)[O-]

Computed descriptors from PubChem (CID 1380749), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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