2-[(2S)-2-(3,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide

C16H14Cl2N2O3S — CID 93143235

About 2-[(2S)-2-(3,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide

2-[(2S)-2-(3,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide (PubChem CID 93143235) has the molecular formula C16H14Cl2N2O3S and a molecular weight of 385.27 g/mol. Its IUPAC name is 2-[(2S)-2-(3,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide.

Molecular Properties

• Compound Name: 2-[(2S)-2-(3,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide
• PubChem CID: 93143235
• Molecular Formula: C16H14Cl2N2O3S
• Molecular Weight: 385.27 g/mol
• Exact Mass: 384.01
• IUPAC Name: 2-[(2S)-2-(3,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide
• SMILES: O=C(CN1C(=O)CS[C@H]1c1ccc(Cl)c(Cl)c1)NCc1ccco1
• InChI: InChI=1S/C16H14Cl2N2O3S/c17-12-4-3-10(6-13(12)18)16-20(15(22)9-24-16)8-14(21)19-7-11-2-1-5-23-11/h1-6,16H,7-9H2,(H,19,21)/t16-/m0/s1
• InChIKey: LBNVKADULHKRFY-INIZCTEOSA-N
• XLogP: 3.48
• TPSA: 62.55 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	385.27
LogP ≤ 5	3.48
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 2-[(2S)-2-(3,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide?

The IUPAC name of 2-[(2S)-2-(3,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide (CID 93143235) is 2-[(2S)-2-(3,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide.

What is the SMILES notation for 2-[(2S)-2-(3,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide?

The canonical SMILES for 2-[(2S)-2-(3,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide is O=C(CN1C(=O)CS[C@H]1c1ccc(Cl)c(Cl)c1)NCc1ccco1.

What is the InChIKey of 2-[(2S)-2-(3,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide?

The InChIKey is LBNVKADULHKRFY-INIZCTEOSA-N. The full InChI is InChI=1S/C16H14Cl2N2O3S/c17-12-4-3-10(6-13(12)18)16-20(15(22)9-24-16)8-14(21)19-7-11-2-1-5-23-11/h1-6,16H,7-9H2,(H,19,21)/t16-/m0/s1.

What are the key properties of 2-[(2S)-2-(3,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide?

2-[(2S)-2-(3,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide has a molecular weight of 385.27 g/mol, XLogP of 3.48, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(2S)-2-(3,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide is sourced from PubChem (CID 93143235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).