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(5Z)-5-[(5-bromo-2-methoxyphenyl)methylidene]-3-methyl-2-sulfanylideneimidazolidin-4-one

(5Z)-5-[(5-bromo-2-methoxyphenyl)methylidene]-3-methyl-2-sulfanylideneimidazolidin-4-one

Formula: C12H11BrN2O2S

SMILES: COC1=CC=C(Br)C=C1C=C1/NC(=S)N(C)C1=O

IUPAC: (5Z)-5-[(5-bromo-2-methoxyphenyl)methylidene]-3-methyl-2-sulfanylideneimidazolidin-4-one

InChI: InChI=1S/C12H11BrN2O2S/c1-15-11(16)9(14-12(15)18)6-7-5-8(13)3-4-10(7)17-2/h3-6H,1-2H3,(H,14,18)/b9-6-

Composition: C (44.05%), H (3.39%), Br (24.42%), N (8.56%), O (9.78%), S (9.80%)

Molar Mass: 327.2

Atom Count: 29

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 325.972462
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey HEPMVTQFADFSPY-TWGQIWQCSA-N
Lipinski's Rule of Five 1
Molar Refractivity 78.7
Topological Polar Surface Area 41.57
Polarizability 29.65
Ring Count 2
Rotatable Bond Count 2

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C12H11BrN2O2S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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