3-[2-[4-[2-[(2R,3S)-3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-4-oxoazetidin-2-yl]acetyl]phenoxy]acetyl]-1,3-oxazolidin-2-one

C24H34N2O7Si — CID 173124372

About 3-[2-[4-[2-[(2R,3S)-3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-4-oxoazetidin-2-yl]acetyl]phenoxy]acetyl]-1,3-oxazolidin-2-one

3-[2-[4-[2-[(2R,3S)-3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-4-oxoazetidin-2-yl]acetyl]phenoxy]acetyl]-1,3-oxazolidin-2-one (PubChem CID 173124372) has the molecular formula C24H34N2O7Si and a molecular weight of 490.63 g/mol. Its IUPAC name is 3-[2-[4-[2-[(2R,3S)-3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-4-oxoazetidin-2-yl]acetyl]phenoxy]acetyl]-1,3-oxazolidin-2-one.

Molecular Properties

• Compound Name: 3-[2-[4-[2-[(2R,3S)-3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-4-oxoazetidin-2-yl]acetyl]phenoxy]acetyl]-1,3-oxazolidin-2-one
• PubChem CID: 173124372
• Molecular Formula: C24H34N2O7Si
• Molecular Weight: 490.63 g/mol
• Exact Mass: 490.21
• IUPAC Name: 3-[2-[4-[2-[(2R,3S)-3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-4-oxoazetidin-2-yl]acetyl]phenoxy]acetyl]-1,3-oxazolidin-2-one
• SMILES: C[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1C(=O)N[C@@H]1CC(=O)c1ccc(OCC(=O)N2CCOC2=O)cc1
• InChI: InChI=1S/C24H34N2O7Si/c1-15(33-34(5,6)24(2,3)4)21-18(25-22(21)29)13-19(27)16-7-9-17(10-8-16)32-14-20(28)26-11-12-31-23(26)30/h7-10,15,18,21H,11-14H2,1-6H3,(H,25,29)/t15-,18-,21-/m1/s1
• InChIKey: BWXAJXNAMCXXAF-FQELHTAISA-N
• XLogP: 3.14
• TPSA: 111.24 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 9
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	490.63
LogP ≤ 5	3.14
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-[2-[4-[2-[(2R,3S)-3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-4-oxoazetidin-2-yl]acetyl]phenoxy]acetyl]-1,3-oxazolidin-2-one?

The IUPAC name of 3-[2-[4-[2-[(2R,3S)-3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-4-oxoazetidin-2-yl]acetyl]phenoxy]acetyl]-1,3-oxazolidin-2-one (CID 173124372) is 3-[2-[4-[2-[(2R,3S)-3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-4-oxoazetidin-2-yl]acetyl]phenoxy]acetyl]-1,3-oxazolidin-2-one.

What is the SMILES notation for 3-[2-[4-[2-[(2R,3S)-3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-4-oxoazetidin-2-yl]acetyl]phenoxy]acetyl]-1,3-oxazolidin-2-one?

The canonical SMILES for 3-[2-[4-[2-[(2R,3S)-3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-4-oxoazetidin-2-yl]acetyl]phenoxy]acetyl]-1,3-oxazolidin-2-one is C[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1C(=O)N[C@@H]1CC(=O)c1ccc(OCC(=O)N2CCOC2=O)cc1.

What is the InChIKey of 3-[2-[4-[2-[(2R,3S)-3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-4-oxoazetidin-2-yl]acetyl]phenoxy]acetyl]-1,3-oxazolidin-2-one?

The InChIKey is BWXAJXNAMCXXAF-FQELHTAISA-N. The full InChI is InChI=1S/C24H34N2O7Si/c1-15(33-34(5,6)24(2,3)4)21-18(25-22(21)29)13-19(27)16-7-9-17(10-8-16)32-14-20(28)26-11-12-31-23(26)30/h7-10,15,18,21H,11-14H2,1-6H3,(H,25,29)/t15-,18-,21-/m1/s1.

What are the key properties of 3-[2-[4-[2-[(2R,3S)-3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-4-oxoazetidin-2-yl]acetyl]phenoxy]acetyl]-1,3-oxazolidin-2-one?

3-[2-[4-[2-[(2R,3S)-3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-4-oxoazetidin-2-yl]acetyl]phenoxy]acetyl]-1,3-oxazolidin-2-one has a molecular weight of 490.63 g/mol, XLogP of 3.14, 9 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[2-[4-[2-[(2R,3S)-3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-4-oxoazetidin-2-yl]acetyl]phenoxy]acetyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 173124372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).