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ethyl 2-[(5Z)-5-{[4-(dimethylamino)phenyl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetate

ethyl 2-[(5Z)-5-{[4-(dimethylamino)phenyl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetate

Formula: C16H18N2O4S

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

IUPAC: ethyl 2-[(5Z)-5-{[4-(dimethylamino)phenyl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetate

InChI: InChI=1S/C16H18N2O4S/c1-4-22-14(19)10-18-15(20)13(23-16(18)21)9-11-5-7-12(8-6-11)17(2)3/h5-9H,4,10H2,1-3H3/b13-9-

Composition: C (57.47%), H (5.43%), N (8.38%), O (19.14%), S (9.59%)

Molar Mass: 334.39

Atom Count: 41

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 334.098728242
Formal Charge 0
FSP3 0.31
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey PTDVALOQJMISHZ-LCYFTJDESA-N
Lipinski's Rule of Five 1
Molar Refractivity 91.15
Topological Polar Surface Area 66.92
Polarizability 34.1
Ring Count 2
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H18N2O4S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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