3-Ethyl-5-[(phenylamino)methylene]-2-thioxo-4-thiazolidinone

3-Ethyl-5-[(phenylamino)methylene]-2-thioxo-4-thiazolidinone
Compound Structure:
Synonyms: 39542-83-1;3-ethyl-5-[(phenylamino)methylene]-2-thioxo-4-thiazolidinone;4-Thiazolidinone, 3-ethyl-5-[(phenylamino)methylene]-2-thioxo-;3-Ethyl-5-phenylaminomethylene-2-thioxo-thiazolidin-4-one;118050-10-5;SMR000280182
Compound ID: NMPC-352
PubChem ID:

170221
Molecular Formula: C12H12N2OS2
Canonical SMILES: CCN1C(=C(SC1=S)C=NC2=CC=CC=C2)O
InChIKey: ZMUTZNCDEDSUFW-UHFFFAOYSA-N
About the compound:
Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

264.4 g/mol

XLogP3-AA

2.8

Hydrogen Bond Donor Count

1

Hydrogen Bond Acceptor Count

4

Rotatable Bond Count

3

Exact Mass

264.03910536 g/mol

Monoisotopic Mass

264.03910536 g/mol

Topological Polar Surface Area

93.2Ų

Heavy Atom Count

17

Formal Charge

0

Complexity

360

Isotope Atom Count

0

Defined Atom Stereocenter Count

0

Undefined Atom Stereocenter Count

0

Defined Bond Stereocenter Count

0

Undefined Bond Stereocenter Count

0

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

Source: PubChem                                                         
Source Species: Terminalia superba
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