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2-[(E)-{2-[(2E)-5-{[(4-fluorophenyl)carbamoyl]methyl}-4-oxo-1,3-thiazolidin-2-ylidene]hydrazin-1-ylidene}methyl]phenyl benzenesulfonate

2-[(E)-{2-[(2E)-5-{[(4-fluorophenyl)carbamoyl]methyl}-4-oxo-1,3-thiazolidin-2-ylidene]hydrazin-1-ylidene}methyl]phenyl benzenesulfonate

Formula: C24H19FN4O5S2

SMILES: FC1=CC=C(NC(=O)CC2SC(NC2=O)=NN=CC2=CC=CC=C2OS(=O)(=O)C2=CC=CC=C2)C=C1

IUPAC: 2-[(E)-{2-[(2E)-5-{[(4-fluorophenyl)carbamoyl]methyl}-4-oxo-1,3-thiazolidin-2-ylidene]hydrazin-1-ylidene}methyl]phenyl benzenesulfonate

InChI: InChI=1/C24H19FN4O5S2/c25-17-10-12-18(13-11-17)27-22(30)14-21-23(31)28-24(35-21)29-26-15-16-6-4-5-9-20(16)34-36(32,33)19-7-2-1-3-8-19/h1-13,15,21H,14H2,(H,27,30)(H,28,29,31)/b26-15+

Composition: C (54.75%), H (3.64%), F (3.61%), N (10.64%), O (15.19%), S (12.18%)

Molar Mass: 526.56

Atom Count: 55

Heavy Atom Count: 36

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 526.078090239
Formal Charge 0
FSP3 0.08
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 2
InChIKey CWGULMWTSFHARY-CVKSISIWNA-N
Lipinski's Rule of Five
Molar Refractivity 134.6
Topological Polar Surface Area 126.29
Polarizability 51.34
Ring Count 4
Rotatable Bond Count 8

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C24H19FN4O5S2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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