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5-[(3-chloro-4-hydroxyphenyl)methylidene]-3-phenyl-2-sulfanylideneimidazolidin-4-one

5-[(3-chloro-4-hydroxyphenyl)methylidene]-3-phenyl-2-sulfanylideneimidazolidin-4-one

CAS: 497835-71-9

Formula: C16H11ClN2O2S

SMILES: OC1=C(Cl)C=C(C=C2NC(=S)N(C2=O)C2=CC=CC=C2)C=C1

IUPAC: 5-[(3-chloro-4-hydroxyphenyl)methylidene]-3-phenyl-2-sulfanylideneimidazolidin-4-one

InChI: InChI=1S/C16H11ClN2O2S/c17-12-8-10(6-7-14(12)20)9-13-15(21)19(16(22)18-13)11-4-2-1-3-5-11/h1-9,20H,(H,18,22)

Composition: C (58.10%), H (3.35%), Cl (10.72%), N (8.47%), O (9.67%), S (9.69%)

Molar Mass: 330.79

Atom Count: 33

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 330.0229765
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey QRDCGTGWWMTBGN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 91.18
Topological Polar Surface Area 52.57
Polarizability 34.57
Ring Count 3
Rotatable Bond Count 2

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