1-[(2R)-2-(2-fluorophenyl)-1,3-thiazolidin-3-yl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone

C19H16FN3O3S — CID 41099119

About 1-[(2R)-2-(2-fluorophenyl)-1,3-thiazolidin-3-yl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone

1-[(2R)-2-(2-fluorophenyl)-1,3-thiazolidin-3-yl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone (PubChem CID 41099119) has the molecular formula C19H16FN3O3S and a molecular weight of 385.42 g/mol. Its IUPAC name is 1-[(2R)-2-(2-fluorophenyl)-1,3-thiazolidin-3-yl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone.

Molecular Properties

• Compound Name: 1-[(2R)-2-(2-fluorophenyl)-1,3-thiazolidin-3-yl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone
• PubChem CID: 41099119
• Molecular Formula: C19H16FN3O3S
• Molecular Weight: 385.42 g/mol
• Exact Mass: 385.09
• IUPAC Name: 1-[(2R)-2-(2-fluorophenyl)-1,3-thiazolidin-3-yl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone
• SMILES: O=C(COc1ccc(-c2nnco2)cc1)N1CCS[C@@H]1c1ccccc1F
• InChI: InChI=1S/C19H16FN3O3S/c20-16-4-2-1-3-15(16)19-23(9-10-27-19)17(24)11-25-14-7-5-13(6-8-14)18-22-21-12-26-18/h1-8,12,19H,9-11H2/t19-/m1/s1
• InChIKey: ISYDAOPQNWQMJG-LJQANCHMSA-N
• XLogP: 3.53
• TPSA: 68.46 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	385.42
LogP ≤ 5	3.53
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-2-(2-fluorophenyl)-1,3-thiazolidin-3-yl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone?

The IUPAC name of 1-[(2R)-2-(2-fluorophenyl)-1,3-thiazolidin-3-yl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone (CID 41099119) is 1-[(2R)-2-(2-fluorophenyl)-1,3-thiazolidin-3-yl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone.

What is the SMILES notation for 1-[(2R)-2-(2-fluorophenyl)-1,3-thiazolidin-3-yl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone?

The canonical SMILES for 1-[(2R)-2-(2-fluorophenyl)-1,3-thiazolidin-3-yl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone is O=C(COc1ccc(-c2nnco2)cc1)N1CCS[C@@H]1c1ccccc1F.

What is the InChIKey of 1-[(2R)-2-(2-fluorophenyl)-1,3-thiazolidin-3-yl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone?

The InChIKey is ISYDAOPQNWQMJG-LJQANCHMSA-N. The full InChI is InChI=1S/C19H16FN3O3S/c20-16-4-2-1-3-15(16)19-23(9-10-27-19)17(24)11-25-14-7-5-13(6-8-14)18-22-21-12-26-18/h1-8,12,19H,9-11H2/t19-/m1/s1.

What are the key properties of 1-[(2R)-2-(2-fluorophenyl)-1,3-thiazolidin-3-yl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone?

1-[(2R)-2-(2-fluorophenyl)-1,3-thiazolidin-3-yl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone has a molecular weight of 385.42 g/mol, XLogP of 3.53, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[(2R)-2-(2-fluorophenyl)-1,3-thiazolidin-3-yl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone is sourced from PubChem (CID 41099119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).