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(5E)-5-(2H-1,3-benzodioxol-5-ylmethylidene)-3-phenyl-1,3-thiazolidine-2,4-dione

(5E)-5-(2H-1,3-benzodioxol-5-ylmethylidene)-3-phenyl-1,3-thiazolidine-2,4-dione

Formula: C17H11NO4S

SMILES: O=C1SC(=CC2=CC=C3OCOC3=C2)C(=O)N1C1=CC=CC=C1

IUPAC: (5E)-5-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-phenyl-1,3-thiazolidine-2,4-dione

InChI: InChI=1S/C17H11NO4S/c19-16-15(9-11-6-7-13-14(8-11)22-10-21-13)23-17(20)18(16)12-4-2-1-3-5-12/h1-9H,10H2/b15-9+

Composition: C (62.76%), H (3.41%), N (4.31%), O (19.67%), S (9.85%)

Molar Mass: 325.34

Atom Count: 34

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 325.040879012
Formal Charge 0
FSP3 0.06
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey YYWPQBAOKFBAHT-OQLLNIDSSA-N
Lipinski's Rule of Five 1
Molar Refractivity 86.66
Topological Polar Surface Area 55.84
Polarizability 33.17
Ring Count 4
Rotatable Bond Count 2

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H11NO4S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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