(2S)-3-[3-[(2S)-4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl]propyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one

C17H18N2O2S4 — CID 10093008

IUPAC(2S)-3-[3-[(2S)-4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl]propyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one
SMILESO=C1CS[C@@H](c2cccs2)N1CCCN1C(=O)CS[C@H]1c1cccs1
InChIInChI=1S/C17H18N2O2S4/c20-14-10-24-16(12-4-1-8-22-12)18(14)6-3-7-19-15(21)11-25-17(19)13-5-2-9-23-13/h1-2,4-5,8-9,16-17H,3,6-7,10-11H2/t16-,17-/m0/s1
InChIKeyRHNQPOCHVDDARC-IRXDYDNUSA-N
MW410.61 g/mol
LogP4.05
Rot. Bonds6

About (2S)-3-[3-[(2S)-4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl]propyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one

(2S)-3-[3-[(2S)-4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl]propyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one (PubChem CID 10093008) has the molecular formula C17H18N2O2S4 and a molecular weight of 410.61 g/mol. Its IUPAC name is (2S)-3-[3-[(2S)-4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl]propyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name(2S)-3-[3-[(2S)-4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl]propyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one
PubChem CID10093008
Molecular FormulaC17H18N2O2S4
Molecular Weight410.61 g/mol
Exact Mass410.03
IUPAC Name(2S)-3-[3-[(2S)-4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl]propyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one
SMILESO=C1CS[C@@H](c2cccs2)N1CCCN1C(=O)CS[C@H]1c1cccs1
InChIInChI=1S/C17H18N2O2S4/c20-14-10-24-16(12-4-1-8-22-12)18(14)6-3-7-19-15(21)11-25-17(19)13-5-2-9-23-13/h1-2,4-5,8-9,16-17H,3,6-7,10-11H2/t16-,17-/m0/s1
InChIKeyRHNQPOCHVDDARC-IRXDYDNUSA-N
XLogP4.05
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.61
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze (2S)-3-[3-[(2S)-4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl]propyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one 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

3-(2-hydroxyethyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one
CID 3447830
methyl 3-(4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl)propanoate
CID 3873645
3-(2-phenoxyethyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one
CID 4657694
3-[(2-fluorophenyl)methyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one
CID 3741447
3-[2-(4-propanoylpiperazin-1-yl)ethyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one
CID 42815016
N-ethyl-2-(4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl)acetamide
CID 42815196
3-[2-(4-hydroxy-3-methoxyphenyl)ethyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one
CID 3873599
2-thiophen-2-yl-3-[(2,4,6-trimethoxyphenyl)methyl]-1,3-thiazolidin-4-one
CID 3873596
3-[(2,3-dimethoxyphenyl)methyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one
CID 3313737
2-(5-chlorothiophen-2-yl)-3-(3-hydroxypropyl)-1,3-thiazolidin-4-one
CID 3768895
3-(2-fluorophenyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one
CID 4054922
3-(3-methylsulfanylpropyl)-2-phenyl-1,3-thiazolidin-4-one
CID 3687079

Frequently Asked Questions

What is the IUPAC name of (2S)-3-[3-[(2S)-4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl]propyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one?
The IUPAC name of (2S)-3-[3-[(2S)-4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl]propyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one (CID 10093008) is (2S)-3-[3-[(2S)-4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl]propyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one.
What is the SMILES notation for (2S)-3-[3-[(2S)-4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl]propyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one?
The canonical SMILES for (2S)-3-[3-[(2S)-4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl]propyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one is O=C1CS[C@@H](c2cccs2)N1CCCN1C(=O)CS[C@H]1c1cccs1.
What is the InChIKey of (2S)-3-[3-[(2S)-4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl]propyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one?
The InChIKey is RHNQPOCHVDDARC-IRXDYDNUSA-N. The full InChI is InChI=1S/C17H18N2O2S4/c20-14-10-24-16(12-4-1-8-22-12)18(14)6-3-7-19-15(21)11-25-17(19)13-5-2-9-23-13/h1-2,4-5,8-9,16-17H,3,6-7,10-11H2/t16-,17-/m0/s1.
What are the key properties of (2S)-3-[3-[(2S)-4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl]propyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one?
(2S)-3-[3-[(2S)-4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl]propyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one has a molecular weight of 410.61 g/mol, XLogP of 4.05, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-3-[3-[(2S)-4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl]propyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one is sourced from PubChem (CID 10093008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).