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(5E)-5-{[3-ethoxy-4-(3-phenoxypropoxy)phenyl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one

(5E)-5-{[3-ethoxy-4-(3-phenoxypropoxy)phenyl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one

Formula: C24H25NO4S2

SMILES: CCOC1=CC(C=C2SC(=S)N(CC=C)C2=O)=CC=C1OCCCOC1=CC=CC=C1

IUPAC: (5E)-5-{[3-ethoxy-4-(3-phenoxypropoxy)phenyl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one

InChI: InChI=1S/C24H25NO4S2/c1-3-13-25-23(26)22(31-24(25)30)17-18-11-12-20(21(16-18)27-4-2)29-15-8-14-28-19-9-6-5-7-10-19/h3,5-7,9-12,16-17H,1,4,8,13-15H2,2H3/b22-17+

Composition: C (63.27%), H (5.53%), N (3.07%), O (14.05%), S (14.07%)

Molar Mass: 455.59

Atom Count: 56

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 455.122500637
Formal Charge 0
FSP3 0.25
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey LUGYUUOGLATHOY-OQKWZONESA-N
Lipinski's Rule of Five
Molar Refractivity 131.36
Topological Polar Surface Area 48
Polarizability 50.59
Ring Count 3
Rotatable Bond Count 11

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C24H25NO4S2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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