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2-(2-methoxy-4-{[(2Z,5Z)-4-oxo-3-(2-phenylethyl)-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetamide

2-(2-methoxy-4-{[(2Z,5Z)-4-oxo-3-(2-phenylethyl)-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetamide

Formula: C27H25N3O4S

SMILES: COC1=CC(C=C2/SC(=N/C3=CC=CC=C3)N(CCC3=CC=CC=C3)C2=O)=CC=C1OCC(N)=O

IUPAC: 2-(2-methoxy-4-{[(2Z,5Z)-4-oxo-3-(2-phenylethyl)-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetamide

InChI: InChI=1S/C27H25N3O4S/c1-33-23-16-20(12-13-22(23)34-18-25(28)31)17-24-26(32)30(15-14-19-8-4-2-5-9-19)27(35-24)29-21-10-6-3-7-11-21/h2-13,16-17H,14-15,18H2,1H3,(H2,28,31)/b24-17-,29-27-

Composition: C (66.51%), H (5.17%), N (8.62%), O (13.13%), S (6.58%)

Molar Mass: 487.57

Atom Count: 60

Heavy Atom Count: 35

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 487.156577471
Formal Charge 0
FSP3 0.15
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey LZDUGLCYJACSLV-JTGJOCGUSA-N
Lipinski's Rule of Five 1
Molar Refractivity 140.06
Topological Polar Surface Area 94.22
Polarizability 52.69
Ring Count 4
Rotatable Bond Count 9

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C27H25N3O4S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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