For research use only. Not for therapeutic Use.
Dehydro-ZINC39395747 is a derivative of ZINC39395747. ZINC39395747 is a potent cytochrome b5 reductase 3 (CYB5R3) inhibitor with an IC50 of 9.14 μM and a Kd of 1.11 μM. ZINC39395747 can increase NO bioavailability in vascular cells[1].
Catalog Number | I017266 |
CAS Number | 433248-87-4 |
Synonyms | 6-(1,3-benzoxazol-2-ylsulfanylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one |
Molecular Formula | C12H9N3O2S2 |
Purity | ≥95% |
InChI | InChI=1S/C12H9N3O2S2/c16-10-5-7(13-11(18)15-10)6-19-12-14-8-3-1-2-4-9(8)17-12/h1-5H,6H2,(H2,13,15,16,18) |
InChIKey | ZBZUSIRGXUAECB-UHFFFAOYSA-N |
SMILES | C1=CC=C2C(=C1)N=C(O2)SCC3=CC(=O)NC(=S)N3 |
Reference | [1]. Rahaman MM, et al. Structure Guided Chemical Modifications of Propylthiouracil Reveal Novel Small Molecule Inhibitors of Cytochrome b5 Reductase 3 That Increase Nitric Oxide Bioavailability. J Biol Chem. 2015 Jul 3;290(27):16861-72. |