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methyl 2-[(5E)-2,4-dioxo-5-[(5-phenylfuran-2-yl)methylidene]-1,3-thiazolidin-3-yl]acetate

methyl 2-[(5E)-2,4-dioxo-5-[(5-phenylfuran-2-yl)methylidene]-1,3-thiazolidin-3-yl]acetate

Formula: C17H13NO5S

SMILES: COC(=O)CN1C(=O)SC(=CC2=CC=C(O2)C2=CC=CC=C2)C1=O

IUPAC: methyl 2-[(5E)-2,4-dioxo-5-[(5-phenylfuran-2-yl)methylidene]-1,3-thiazolidin-3-yl]acetate

InChI: InChI=1S/C17H13NO5S/c1-22-15(19)10-18-16(20)14(24-17(18)21)9-12-7-8-13(23-12)11-5-3-2-4-6-11/h2-9H,10H2,1H3/b14-9+

Composition: C (59.47%), H (3.82%), N (4.08%), O (23.30%), S (9.34%)

Molar Mass: 343.35

Atom Count: 37

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 343.051443697
Formal Charge 0
FSP3 0.12
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey ITYCJFOGLJZNPZ-NTEUORMPSA-N
Lipinski's Rule of Five 1
Molar Refractivity 89.38
Topological Polar Surface Area 76.82
Polarizability 35.24
Ring Count 3
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H13NO5S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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