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Chemical structure of Dehydro-ZINC39395747

GC60127

Dehydro-ZINC39395747

Also known as 6-(1,3-benzoxazol-2-ylsulfanylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one

Dehydro-ZINC39395747 is a derivative of ZINC39395747

ChemicalCAS433248-87-4MW291.35FormulaC12H9N3O2S2
CAS number
433248-87-4
Molecular weight
291.35
Formula
C12H9N3O2S2
Solubility
DMSO: 10 mg/mL (34·32 mM; ultrasonic and adjust pH to 6 with HCl)
InChIKey
ZBZUSIRGXUAECB-UHFFFAOYSA-N
Catalogue number
GC60127
Brand
GLPBIO
Computed properties PubChem CID 702583 · XLogP 1.8 · TPSA 125 Ų · H-bond donors 2
XLogP
1.8
TPSA
125 Ų
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
19

SMILES C1=CC=C2C(=C1)N=C(O2)SCC3=CC(=O)NC(=S)N3

Computed descriptors from PubChem (CID 702583), 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
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