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

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

Formula: C15H15NO4S

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

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

InChI: InChI=1S/C15H15NO4S/c1-3-20-13(17)9-16-14(18)12(21-15(16)19)8-11-6-4-10(2)5-7-11/h4-8H,3,9H2,1-2H3/b12-8+

Composition: C (59.00%), H (4.95%), N (4.59%), O (20.96%), S (10.50%)

Molar Mass: 305.35

Atom Count: 36

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 305.072179141
Formal Charge 0
FSP3 0.27
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey BIZMMICAXDMOKO-XYOKQWHBSA-N
Lipinski's Rule of Five 1
Molar Refractivity 81.76
Topological Polar Surface Area 63.68
Polarizability 31.04
Ring Count 2
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C15H15NO4S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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