2-(3-hydroxyphenyl)-3-(4-morpholin-4-ylphenyl)-1,3-thiazolidin-4-one

C19H20N2O3S — CID 10360916

IUPAC2-(3-hydroxyphenyl)-3-(4-morpholin-4-ylphenyl)-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2cccc(O)c2)N1c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C19H20N2O3S/c22-17-3-1-2-14(12-17)19-21(18(23)13-25-19)16-6-4-15(5-7-16)20-8-10-24-11-9-20/h1-7,12,19,22H,8-11,13H2
InChIKeyOYJKNRAICUXKKK-UHFFFAOYSA-N
MW356.45 g/mol
LogP3.01
Rot. Bonds3

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

2-(3-hydroxyphenyl)-3-(4-morpholin-4-ylphenyl)-1,3-thiazolidin-4-one (PubChem CID 10360916) has the molecular formula C19H20N2O3S and a molecular weight of 356.45 g/mol. Its IUPAC name is 2-(3-hydroxyphenyl)-3-(4-morpholin-4-ylphenyl)-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name2-(3-hydroxyphenyl)-3-(4-morpholin-4-ylphenyl)-1,3-thiazolidin-4-one
PubChem CID10360916
Molecular FormulaC19H20N2O3S
Molecular Weight356.45 g/mol
Exact Mass356.12
IUPAC Name2-(3-hydroxyphenyl)-3-(4-morpholin-4-ylphenyl)-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2cccc(O)c2)N1c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C19H20N2O3S/c22-17-3-1-2-14(12-17)19-21(18(23)13-25-19)16-6-4-15(5-7-16)20-8-10-24-11-9-20/h1-7,12,19,22H,8-11,13H2
InChIKeyOYJKNRAICUXKKK-UHFFFAOYSA-N
XLogP3.01
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.45
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

3-(4-morpholin-4-ylphenyl)-2-phenyl-1,3-thiazolidin-4-one
CID 10337318
(2S)-3-[4-[(2S)-4-oxo-2-phenyl-1,3-thiazolidin-3-yl]phenyl]-2-phenyl-1,3-thiazolidin-4-one
CID 1041463
2-[3-(trifluoromethyl)phenyl]-3-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one
CID 25071743
2-(3-bromophenyl)-3-(4-iodophenyl)-1,3-thiazolidin-4-one
CID 3279534
2-(3-aminophenyl)-3-(4-fluorophenyl)-1,3-thiazolidin-4-one
CID 42803978
2-(3-hydroxyphenyl)-3-[5-(2-hydroxyphenyl)-1,3,4-thiadiazol-2-yl]-1,3-thiazolidin-4-one
CID 135439612
3-(4-hydroxyphenyl)-2-(4-methylphenyl)-1,3-thiazolidin-4-one
CID 5057465
3-(4-morpholin-4-ylphenyl)phenol
CID 46887508
3-(4-bromophenyl)-2-(3-nitrophenyl)-1,3-thiazolidin-4-one
CID 15992471
3-(3,4-dichlorophenyl)-2-(3-methylphenyl)-1,3-thiazolidin-4-one
CID 145366980
(2S)-3-(4-phenoxyphenyl)-2-phenyl-1,3-thiazolidin-4-one
CID 6935175
2-(3-bromophenyl)-3-(3-chloro-4-methylphenyl)-1,3-thiazolidin-4-one
CID 3288399

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxyphenyl)-3-(4-morpholin-4-ylphenyl)-1,3-thiazolidin-4-one?
The IUPAC name of 2-(3-hydroxyphenyl)-3-(4-morpholin-4-ylphenyl)-1,3-thiazolidin-4-one (CID 10360916) is 2-(3-hydroxyphenyl)-3-(4-morpholin-4-ylphenyl)-1,3-thiazolidin-4-one.
What is the SMILES notation for 2-(3-hydroxyphenyl)-3-(4-morpholin-4-ylphenyl)-1,3-thiazolidin-4-one?
The canonical SMILES for 2-(3-hydroxyphenyl)-3-(4-morpholin-4-ylphenyl)-1,3-thiazolidin-4-one is O=C1CSC(c2cccc(O)c2)N1c1ccc(N2CCOCC2)cc1.
What is the InChIKey of 2-(3-hydroxyphenyl)-3-(4-morpholin-4-ylphenyl)-1,3-thiazolidin-4-one?
The InChIKey is OYJKNRAICUXKKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3S/c22-17-3-1-2-14(12-17)19-21(18(23)13-25-19)16-6-4-15(5-7-16)20-8-10-24-11-9-20/h1-7,12,19,22H,8-11,13H2.
What are the key properties of 2-(3-hydroxyphenyl)-3-(4-morpholin-4-ylphenyl)-1,3-thiazolidin-4-one?
2-(3-hydroxyphenyl)-3-(4-morpholin-4-ylphenyl)-1,3-thiazolidin-4-one has a molecular weight of 356.45 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxyphenyl)-3-(4-morpholin-4-ylphenyl)-1,3-thiazolidin-4-one is sourced from PubChem (CID 10360916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).