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

C9H8N2O2S — CID 135439019

IUPAC2-(3-hydroxyphenyl)imino-1,3-thiazolidin-4-one
SMILESO=C1CS/C(=N/c2cccc(O)c2)N1
InChIInChI=1S/C9H8N2O2S/c12-7-3-1-2-6(4-7)10-9-11-8(13)5-14-9/h1-4,12H,5H2,(H,10,11,13)
InChIKeyZSOFCUKMJWLILQ-UHFFFAOYSA-N
MW208.24 g/mol
LogP1.24
Rot. Bonds1

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

2-(3-hydroxyphenyl)imino-1,3-thiazolidin-4-one (PubChem CID 135439019) has the molecular formula C9H8N2O2S and a molecular weight of 208.24 g/mol. Its IUPAC name is 2-(3-hydroxyphenyl)imino-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name2-(3-hydroxyphenyl)imino-1,3-thiazolidin-4-one
PubChem CID135439019
Molecular FormulaC9H8N2O2S
Molecular Weight208.24 g/mol
Exact Mass208.03
IUPAC Name2-(3-hydroxyphenyl)imino-1,3-thiazolidin-4-one
SMILESO=C1CS/C(=N/c2cccc(O)c2)N1
InChIInChI=1S/C9H8N2O2S/c12-7-3-1-2-6(4-7)10-9-11-8(13)5-14-9/h1-4,12H,5H2,(H,10,11,13)
InChIKeyZSOFCUKMJWLILQ-UHFFFAOYSA-N
XLogP1.24
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.24
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2-[(4-hydroxyphenyl)amino]-1,3-thiazol-4(5H)-one
CID 135435921
N-(3-hydroxyphenyl)-3,7-dimethyl-5-oxo-6-thiazolo[3,2-a]pyrimidinesulfonamide
CID 15990025
[2-(4-Hydroxy-phenylimino)-4-oxo-thiazolidin-5-yl]-acetic acid
CID 135412572
2-(3-hydroxyphenylamino)-5-(thiophen-2-ylmethylene)thiazol-4(5H)-one
CID 135522709
3-Allyl-2-[(4-hydroxyphenyl)imino]-1,3-thiazolidin-4-one
CID 1230260
3-Allyl-2-[(3-hydroxyphenyl)imino]-1,3-thiazolidin-4-one
CID 1314309
3-[(5-Methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]phenol
CID 3515862
{2-[(3-Hydroxyphenyl)imino]-4-oxo-1,3-thiazolidin-5-yl}acetic acid
CID 135435959
2-[(3-Hydroxyphenyl)amino]-5-[(3-hydroxyphenyl)methylene]-1,3-thiazolin-4-one
CID 135492171
N-(3-hydroxyphenyl)-2-[(4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidin-2-yl)thio]acetamide
CID 135546883
3-[[(5S)-5-methyl-4,5-dihydro-1,3-thiazol-2-yl]amino]phenol
CID 818363
4-[(2-Hydroxyphenyl)azamethylene]-1,3-thiazolidin-2-one
CID 135486426

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxyphenyl)imino-1,3-thiazolidin-4-one?
The IUPAC name of 2-(3-hydroxyphenyl)imino-1,3-thiazolidin-4-one (CID 135439019) is 2-(3-hydroxyphenyl)imino-1,3-thiazolidin-4-one.
What is the SMILES notation for 2-(3-hydroxyphenyl)imino-1,3-thiazolidin-4-one?
The canonical SMILES for 2-(3-hydroxyphenyl)imino-1,3-thiazolidin-4-one is O=C1CS/C(=N/c2cccc(O)c2)N1.
What is the InChIKey of 2-(3-hydroxyphenyl)imino-1,3-thiazolidin-4-one?
The InChIKey is ZSOFCUKMJWLILQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O2S/c12-7-3-1-2-6(4-7)10-9-11-8(13)5-14-9/h1-4,12H,5H2,(H,10,11,13).
What are the key properties of 2-(3-hydroxyphenyl)imino-1,3-thiazolidin-4-one?
2-(3-hydroxyphenyl)imino-1,3-thiazolidin-4-one has a molecular weight of 208.24 g/mol, XLogP of 1.24, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxyphenyl)imino-1,3-thiazolidin-4-one is sourced from PubChem (CID 135439019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).