2-(2-hydroxyphenyl)imino-3-phenyl-1,3-thiazolidin-4-one

C15H12N2O2S — CID 4149001

IUPAC2-(2-hydroxyphenyl)imino-3-phenyl-1,3-thiazolidin-4-one
SMILESO=C1CS/C(=N\c2ccccc2O)N1c1ccccc1
InChIInChI=1S/C15H12N2O2S/c18-13-9-5-4-8-12(13)16-15-17(14(19)10-20-15)11-6-2-1-3-7-11/h1-9,18H,10H2/b16-15-
InChIKeyUNHLBBRSAOEMKG-NXVVXOECSA-N
MW284.34 g/mol
LogP3.16
Rot. Bonds2

About 2-(2-hydroxyphenyl)imino-3-phenyl-1,3-thiazolidin-4-one

2-(2-hydroxyphenyl)imino-3-phenyl-1,3-thiazolidin-4-one (PubChem CID 4149001) has the molecular formula C15H12N2O2S and a molecular weight of 284.34 g/mol. Its IUPAC name is 2-(2-hydroxyphenyl)imino-3-phenyl-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name2-(2-hydroxyphenyl)imino-3-phenyl-1,3-thiazolidin-4-one
PubChem CID4149001
Molecular FormulaC15H12N2O2S
Molecular Weight284.34 g/mol
Exact Mass284.06
IUPAC Name2-(2-hydroxyphenyl)imino-3-phenyl-1,3-thiazolidin-4-one
SMILESO=C1CS/C(=N\c2ccccc2O)N1c1ccccc1
InChIInChI=1S/C15H12N2O2S/c18-13-9-5-4-8-12(13)16-15-17(14(19)10-20-15)11-6-2-1-3-7-11/h1-9,18H,10H2/b16-15-
InChIKeyUNHLBBRSAOEMKG-NXVVXOECSA-N
XLogP3.16
TPSA52.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_phenol_A(3)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyphenyl)imino-3-phenyl-1,3-thiazolidin-4-one?
The IUPAC name of 2-(2-hydroxyphenyl)imino-3-phenyl-1,3-thiazolidin-4-one (CID 4149001) is 2-(2-hydroxyphenyl)imino-3-phenyl-1,3-thiazolidin-4-one.
What is the SMILES notation for 2-(2-hydroxyphenyl)imino-3-phenyl-1,3-thiazolidin-4-one?
The canonical SMILES for 2-(2-hydroxyphenyl)imino-3-phenyl-1,3-thiazolidin-4-one is O=C1CS/C(=N\c2ccccc2O)N1c1ccccc1.
What is the InChIKey of 2-(2-hydroxyphenyl)imino-3-phenyl-1,3-thiazolidin-4-one?
The InChIKey is UNHLBBRSAOEMKG-NXVVXOECSA-N. The full InChI is InChI=1S/C15H12N2O2S/c18-13-9-5-4-8-12(13)16-15-17(14(19)10-20-15)11-6-2-1-3-7-11/h1-9,18H,10H2/b16-15-.
What are the key properties of 2-(2-hydroxyphenyl)imino-3-phenyl-1,3-thiazolidin-4-one?
2-(2-hydroxyphenyl)imino-3-phenyl-1,3-thiazolidin-4-one has a molecular weight of 284.34 g/mol, XLogP of 3.16, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyphenyl)imino-3-phenyl-1,3-thiazolidin-4-one is sourced from PubChem (CID 4149001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).