946769-33-1 Purity
96%
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Specification
The molecular formula is C10H9FN4OS.
The molecular weight is 252.27 g/mol.
The IUPAC name is 2-(5-amino-1,3,4-thiadiazol-2-yl)-N-(2-fluorophenyl)acetamide.
The InChI is InChI=1S/C10H9FN4OS/c11-6-3-1-2-4-7(6)13-8(16)5-9-14-15-10(12)17-9/h1-4H,5H2,(H2,12,15)(H,13,16).
The InChIKey is SBZNLKFJPVXTLH-UHFFFAOYSA-N.
The Canonical SMILES is C1=CC=C(C(=C1)NC(=O)CC2=NN=C(S2)N)F.
The XLogP3-AA value is 0.9.
The compound has 2 hydrogen bond donor count.
The topological polar surface area is 109 Ų.
Yes, the compound is canonicalized.