3-(Benzylamino)-2-imino-1,3-thiazolidin-4-one

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Basic information

CAS: 152449-58-6
Standard SMILES: N=C1SCC(=O)N1NCc1ccccc1
InChIKey: FBSQEKATUGLOOF-UHFFFAOYSA-N
Molecular formula: C10H11N3OS
Average molar mass: 221.28 g/mol
Monoisotopic mass: 221.06228316

Names & identifiers

Preferred name: 3-(Benzylamino)-2-imino-1,3-thiazolidin-4-one
IUPAC: 3-(benzylamino)-2-imino-1,3-thiazolidin-4-one

Names & synonyms

152449-58-63-(benzylamino)-2-imino-1,3-thiazolidin-4-oneDTXSID10934504RefChem:1066997DTXCID9013631512-Amino-3-(benzylideneamino)-4-thiazolidinone2-Imino-3-((phenylmethyl)amino)-4-thiazolidinone4-Thiazolidinone, 2-imino-3-((phenylmethyl)amino)-

Database identifiers

CAS: 152449-58-6
PubChem CID: 3073774
DTXSID: DTXSID10934504

Properties

Computed structural properties

XLogP: 1.6
Topological polar surface area: 81.5 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 4
Rotatable bonds: 3
Heavy atoms: 15
Formal charge: 0
Complexity: 263

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