2-phenylimino-1,3-thiazolidin-4-one

C9H8N2OS — CID 135406265

IUPAC2-phenylimino-1,3-thiazolidin-4-one
SMILESO=C1CS/C(=N\c2ccccc2)N1
InChIInChI=1S/C9H8N2OS/c12-8-6-13-9(11-8)10-7-4-2-1-3-5-7/h1-5H,6H2,(H,10,11,12)
InChIKeyIYGBTPGRKGQPLW-UHFFFAOYSA-N
MW192.24 g/mol
LogP1.54
Rot. Bonds1

About 2-phenylimino-1,3-thiazolidin-4-one

2-phenylimino-1,3-thiazolidin-4-one (PubChem CID 135406265) has the molecular formula C9H8N2OS and a molecular weight of 192.24 g/mol. Its IUPAC name is 2-phenylimino-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name2-phenylimino-1,3-thiazolidin-4-one
PubChem CID135406265
Molecular FormulaC9H8N2OS
Molecular Weight192.24 g/mol
Exact Mass192.04
IUPAC Name2-phenylimino-1,3-thiazolidin-4-one
SMILESO=C1CS/C(=N\c2ccccc2)N1
InChIInChI=1S/C9H8N2OS/c12-8-6-13-9(11-8)10-7-4-2-1-3-5-7/h1-5H,6H2,(H,10,11,12)
InChIKeyIYGBTPGRKGQPLW-UHFFFAOYSA-N
XLogP1.54
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-p-Tolylamino-thiazol-4-one
CID 135411781
(5R)-2-[(2-Fluorophenyl)amino]-5-isopropyl-1,3-thiazol-4(5H)-one
CID 135566336
2-[(4-Fluorophenyl)amino]-4,5-dihydro-1,3-thiazol-4-one
CID 135426081
2-m-Tolylamino-thiazol-4-one
CID 135415496
5-ethyl-2-[(2-methylphenyl)amino]-1,3-thiazol-4(5H)-one
CID 135450677
4-(Phenylamino)-2(5H)-thiazolone
CID 135412584
4-[(4-Oxo-4,5-dihydro-1,3-thiazol-2-yl)amino]benzenesulfonamide
CID 135422576
2-o-Tolylamino-thiazol-4-one
CID 135415405
2-((2,4-Dimethylphenyl)amino)-4,5-dihydro-1,3-thiazol-4-one
CID 135415560
2-(3-Trifluoromethyl-phenylamino)-thiazol-4-one
CID 135448709
(Z)-4-((4-fluorophenyl)imino)thiazolidin-2-one
CID 135399109
2-(3,5-Dimethyl-phenylimino)-thiazolidin-4-one
CID 135459529

Frequently Asked Questions

What is the IUPAC name of 2-phenylimino-1,3-thiazolidin-4-one?
The IUPAC name of 2-phenylimino-1,3-thiazolidin-4-one (CID 135406265) is 2-phenylimino-1,3-thiazolidin-4-one.
What is the SMILES notation for 2-phenylimino-1,3-thiazolidin-4-one?
The canonical SMILES for 2-phenylimino-1,3-thiazolidin-4-one is O=C1CS/C(=N\c2ccccc2)N1.
What is the InChIKey of 2-phenylimino-1,3-thiazolidin-4-one?
The InChIKey is IYGBTPGRKGQPLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2OS/c12-8-6-13-9(11-8)10-7-4-2-1-3-5-7/h1-5H,6H2,(H,10,11,12).
What are the key properties of 2-phenylimino-1,3-thiazolidin-4-one?
2-phenylimino-1,3-thiazolidin-4-one has a molecular weight of 192.24 g/mol, XLogP of 1.54, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylimino-1,3-thiazolidin-4-one is sourced from PubChem (CID 135406265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).