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(2E,5Z)-5-[(2,3-dibromo-5-ethoxy-4-hydroxyphenyl)methylidene]-3-methyl-2-(methylimino)-1,3-thiazolidin-4-one

(2E,5Z)-5-[(2,3-dibromo-5-ethoxy-4-hydroxyphenyl)methylidene]-3-methyl-2-(methylimino)-1,3-thiazolidin-4-one

Formula: C14H14Br2N2O3S

SMILES: CCOC1=CC(C=C2/SC(=NC)N(C)C2=O)=C(Br)C(Br)=C1O

IUPAC: (2E,5Z)-5-[(2,3-dibromo-5-ethoxy-4-hydroxyphenyl)methylidene]-3-methyl-2-(methylimino)-1,3-thiazolidin-4-one

InChI: InChI=1S/C14H14Br2N2O3S/c1-4-21-8-5-7(10(15)11(16)12(8)19)6-9-13(20)18(3)14(17-2)22-9/h5-6,19H,4H2,1-3H3/b9-6-,17-14+

Composition: C (37.36%), H (3.13%), Br (35.50%), N (6.22%), O (10.66%), S (7.12%)

Molar Mass: 450.15

Atom Count: 36

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 447.909189
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey LAZQFRRQYOVZEG-NASOFASHSA-N
Lipinski's Rule of Five 1
Molar Refractivity 96.51
Topological Polar Surface Area 62.13
Polarizability 36.27
Ring Count 2
Rotatable Bond Count 3

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C14H14Br2N2O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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