2-hydroxy-N-[(Z)-[4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-ylidene]amino]-2,2-diphenylacetamide

C25H23N3O3S — CID 14984002

IUPAC2-hydroxy-N-[(Z)-[4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-ylidene]amino]-2,2-diphenylacetamide
SMILESO=C1CS/C(=N\NC(=O)C(O)(c2ccccc2)c2ccccc2)N1CCc1ccccc1
InChIInChI=1S/C25H23N3O3S/c29-22-18-32-24(28(22)17-16-19-10-4-1-5-11-19)27-26-23(30)25(31,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,31H,16-18H2,(H,26,30)/b27-24-
InChIKeyRBDXXUNWVMWGPS-PNHLSOANSA-N
MW445.54 g/mol
LogP3.13
Rot. Bonds7

About 2-hydroxy-N-[(Z)-[4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-ylidene]amino]-2,2-diphenylacetamide

2-hydroxy-N-[(Z)-[4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-ylidene]amino]-2,2-diphenylacetamide (PubChem CID 14984002) has the molecular formula C25H23N3O3S and a molecular weight of 445.54 g/mol. Its IUPAC name is 2-hydroxy-N-[(Z)-[4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-ylidene]amino]-2,2-diphenylacetamide.

Molecular Properties

Compound Name2-hydroxy-N-[(Z)-[4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-ylidene]amino]-2,2-diphenylacetamide
PubChem CID14984002
Molecular FormulaC25H23N3O3S
Molecular Weight445.54 g/mol
Exact Mass445.15
IUPAC Name2-hydroxy-N-[(Z)-[4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-ylidene]amino]-2,2-diphenylacetamide
SMILESO=C1CS/C(=N\NC(=O)C(O)(c2ccccc2)c2ccccc2)N1CCc1ccccc1
InChIInChI=1S/C25H23N3O3S/c29-22-18-32-24(28(22)17-16-19-10-4-1-5-11-19)27-26-23(30)25(31,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,31H,16-18H2,(H,26,30)/b27-24-
InChIKeyRBDXXUNWVMWGPS-PNHLSOANSA-N
XLogP3.13
TPSA82.00 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500445.54
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-hydroxy-N-[(Z)-[4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-ylidene]amino]-2,2-diphenylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(6S)-4-oxo-3-(2-phenylethyl)-2-phenylimino-1,3-thiazinane-6-carboxylic acid
CID 1212213
(6S)-4-oxo-3-(2-phenylethyl)-2-(2-phenylethylimino)-1,3-thiazinane-6-carboxylic acid
CID 1256330
2-hydroxy-N-[(E)-[(2E)-2-[(2-hydroxy-2,2-diphenylacetyl)hydrazinylidene]ethylidene]amino]-2,2-diphenylacetamide
CID 46495023
3-[2-(4-hydroxyphenyl)ethyl]-2-sulfanylidene-1,3-thiazolidin-4-one
CID 18593001
3-(3-hydroxypropyl)-2-phenylimino-1,3-thiazolidin-4-one
CID 121015318
1-[2-(4-tert-butylphenyl)ethyl]-6-hydroxy-3-(2-phenylethyl)pyrimidine-2,4-dione
CID 91209277
3-benzyl-2-phenylimino-1,3-thiazolidin-4-one;hydrochloride
CID 141064791
1,3-bis(2-phenylethyl)-1,3-diazinane-2,4,6-trione
CID 2187415
4-[[(6R)-4-oxo-3-(2-phenylethyl)-2-(2-phenylethylimino)-1,3-thiazinane-6-carbonyl]amino]benzoic acid
CID 40844734
3-[2-(4-methoxyphenyl)ethyl]-4-oxo-N-(2-phenylethyl)-2-[3-(trifluoromethyl)phenyl]imino-1,3-thiazinane-6-carboxamide
CID 3602911
2-butan-2-yl-N,N'-bis[(E)-(4-oxo-3-propyl-1,3-thiazolidin-2-ylidene)amino]propanediamide
CID 10389990
(2E)-3-benzyl-2-(cyclooctylidenehydrazinylidene)-1,3-thiazolidin-4-one
CID 118713906

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[(Z)-[4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-ylidene]amino]-2,2-diphenylacetamide?
The IUPAC name of 2-hydroxy-N-[(Z)-[4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-ylidene]amino]-2,2-diphenylacetamide (CID 14984002) is 2-hydroxy-N-[(Z)-[4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-ylidene]amino]-2,2-diphenylacetamide.
What is the SMILES notation for 2-hydroxy-N-[(Z)-[4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-ylidene]amino]-2,2-diphenylacetamide?
The canonical SMILES for 2-hydroxy-N-[(Z)-[4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-ylidene]amino]-2,2-diphenylacetamide is O=C1CS/C(=N\NC(=O)C(O)(c2ccccc2)c2ccccc2)N1CCc1ccccc1.
What is the InChIKey of 2-hydroxy-N-[(Z)-[4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-ylidene]amino]-2,2-diphenylacetamide?
The InChIKey is RBDXXUNWVMWGPS-PNHLSOANSA-N. The full InChI is InChI=1S/C25H23N3O3S/c29-22-18-32-24(28(22)17-16-19-10-4-1-5-11-19)27-26-23(30)25(31,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,31H,16-18H2,(H,26,30)/b27-24-.
What are the key properties of 2-hydroxy-N-[(Z)-[4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-ylidene]amino]-2,2-diphenylacetamide?
2-hydroxy-N-[(Z)-[4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-ylidene]amino]-2,2-diphenylacetamide has a molecular weight of 445.54 g/mol, XLogP of 3.13, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[(Z)-[4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-ylidene]amino]-2,2-diphenylacetamide is sourced from PubChem (CID 14984002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).