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N-(3,4-dimethylphenyl)-2-[(5E)-5-[(4-methoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide

N-(3,4-dimethylphenyl)-2-[(5E)-5-[(4-methoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide

Formula: C21H20N2O4S

SMILES: COC1=CC=C(C=C2SC(=O)N(CC(=O)NC3=CC=C(C)C(C)=C3)C2=O)C=C1

IUPAC: N-(3,4-dimethylphenyl)-2-[(5E)-5-[(4-methoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide

InChI: InChI=1S/C21H20N2O4S/c1-13-4-7-16(10-14(13)2)22-19(24)12-23-20(25)18(28-21(23)26)11-15-5-8-17(27-3)9-6-15/h4-11H,12H2,1-3H3,(H,22,24)/b18-11+

Composition: C (63.62%), H (5.08%), N (7.07%), O (16.14%), S (8.09%)

Molar Mass: 396.46

Atom Count: 48

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 396.114378306
Formal Charge 0
FSP3 0.19
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey IJNZOLGOHWUICJ-WOJGMQOQSA-N
Lipinski's Rule of Five 1
Molar Refractivity 112.03
Topological Polar Surface Area 75.71
Polarizability 41.64
Ring Count 3
Rotatable Bond Count 5

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C21H20N2O4S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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