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(5Z)-5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one

(5Z)-5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one

CAS: 58215-51-3

Formula: C12H10BrNO3S2

SMILES: COC1=CC(C=C2/SC(=S)N(C)C2=O)=CC(Br)=C1O

IUPAC: (5Z)-5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one

InChI: InChI=1S/C12H10BrNO3S2/c1-14-11(16)9(19-12(14)18)5-6-3-7(13)10(15)8(4-6)17-2/h3-5,15H,1-2H3/b9-5-

Composition: C (40.01%), H (2.80%), Br (22.18%), N (3.89%), O (13.32%), S (17.80%)

Molar Mass: 360.24

Atom Count: 29

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 358.928549
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey SUJMGDLBTPFCMK-UITAMQMPSA-N
Lipinski's Rule of Five 1
Molar Refractivity 85.18
Topological Polar Surface Area 49.77
Polarizability 32.26
Ring Count 2
Rotatable Bond Count 2

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