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(2Z,5Z)-3-(2-methoxyethyl)-2-[(4-methoxyphenyl)imino]-5-[(4-nitrophenyl)methylidene]-1,3-thiazolidin-4-one

(2Z,5Z)-3-(2-methoxyethyl)-2-[(4-methoxyphenyl)imino]-5-[(4-nitrophenyl)methylidene]-1,3-thiazolidin-4-one

Formula: C20H19N3O5S

SMILES: COCCN1C(=O)C(SC1=N/C1=CC=C(OC)C=C1)=CC1=CC=C(C=C1)[N+]([O-])=O

IUPAC: (2Z,5Z)-3-(2-methoxyethyl)-2-[(4-methoxyphenyl)imino]-5-[(4-nitrophenyl)methylidene]-1,3-thiazolidin-4-one

InChI: InChI=1S/C20H19N3O5S/c1-27-12-11-22-19(24)18(13-14-3-7-16(8-4-14)23(25)26)29-20(22)21-15-5-9-17(28-2)10-6-15/h3-10,13H,11-12H2,1-2H3/b18-13-,21-20-

Composition: C (58.10%), H (4.63%), N (10.16%), O (19.35%), S (7.75%)

Molar Mass: 413.45

Atom Count: 48

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 413.104541898
Formal Charge 0
FSP3 0.2
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 0
InChIKey RZXKDLREZRPZSY-PQDITWEDSA-N
Lipinski's Rule of Five 1
Molar Refractivity 113.69
Topological Polar Surface Area 94.27
Polarizability 41.96
Ring Count 3
Rotatable Bond Count 7

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C20H19N3O5S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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