(4S)-3-[(2R,3R)-2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-3-ethyl-5-trimethylsilylpent-4-ynoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;carbon monoxide;cobalt

C40H49Co2NO10Si2 — CID 10876666

About (4S)-3-[(2R,3R)-2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-3-ethyl-5-trimethylsilylpent-4-ynoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;carbon monoxide;cobalt

(4S)-3-[(2R,3R)-2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-3-ethyl-5-trimethylsilylpent-4-ynoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;carbon monoxide;cobalt (PubChem CID 10876666) has the molecular formula C40H49Co2NO10Si2 and a molecular weight of 877.87 g/mol. Its IUPAC name is (4S)-3-[(2R,3R)-2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-3-ethyl-5-trimethylsilylpent-4-ynoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;carbon monoxide;cobalt.

Molecular Properties

• Compound Name: (4S)-3-[(2R,3R)-2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-3-ethyl-5-trimethylsilylpent-4-ynoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;carbon monoxide;cobalt
• PubChem CID: 10876666
• Molecular Formula: C40H49Co2NO10Si2
• Molecular Weight: 877.87 g/mol
• Exact Mass: 877.16
• IUPAC Name: (4S)-3-[(2R,3R)-2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-3-ethyl-5-trimethylsilylpent-4-ynoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;carbon monoxide;cobalt
• SMILES: CC[C@@H](C#C[Si](C)(C)C)[C@@H](CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)C(=O)N1C(=O)OC[C@@H]1C(C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co].[Co]
• InChI: InChI=1S/C34H49NO4Si2.6CO.2Co/c1-10-27(22-24-40(7,8)9)30(32(36)35-31(26(2)3)25-38-33(35)37)21-23-39-41(34(4,5)6,28-17-13-11-14-18-28)29-19-15-12-16-20-29;6*1-2;;/h11-20,26-27,30-31H,10,21,23,25H2,1-9H3;;;;;;;;/t27-,30+,31+;;;;;;;;/m0......../s1
• InChIKey: NIKABQTWRTUWSI-YWHUDFTJSA-N
• XLogP: 6.25
• TPSA: 175.24 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 10
• Heavy Atoms: 55
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	877.87
LogP ≤ 5	6.25
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (4S)-3-[(2R,3R)-2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-3-ethyl-5-trimethylsilylpent-4-ynoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;carbon monoxide;cobalt?

The IUPAC name of (4S)-3-[(2R,3R)-2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-3-ethyl-5-trimethylsilylpent-4-ynoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;carbon monoxide;cobalt (CID 10876666) is (4S)-3-[(2R,3R)-2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-3-ethyl-5-trimethylsilylpent-4-ynoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;carbon monoxide;cobalt.

What is the SMILES notation for (4S)-3-[(2R,3R)-2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-3-ethyl-5-trimethylsilylpent-4-ynoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;carbon monoxide;cobalt?

The canonical SMILES for (4S)-3-[(2R,3R)-2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-3-ethyl-5-trimethylsilylpent-4-ynoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;carbon monoxide;cobalt is CC[C@@H](C#C[Si](C)(C)C)[C@@H](CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)C(=O)N1C(=O)OC[C@@H]1C(C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co].[Co].

What is the InChIKey of (4S)-3-[(2R,3R)-2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-3-ethyl-5-trimethylsilylpent-4-ynoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;carbon monoxide;cobalt?

The InChIKey is NIKABQTWRTUWSI-YWHUDFTJSA-N. The full InChI is InChI=1S/C34H49NO4Si2.6CO.2Co/c1-10-27(22-24-40(7,8)9)30(32(36)35-31(26(2)3)25-38-33(35)37)21-23-39-41(34(4,5)6,28-17-13-11-14-18-28)29-19-15-12-16-20-29;6*1-2;;/h11-20,26-27,30-31H,10,21,23,25H2,1-9H3;;;;;;;;/t27-,30+,31+;;;;;;;;/m0......../s1.

What are the key properties of (4S)-3-[(2R,3R)-2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-3-ethyl-5-trimethylsilylpent-4-ynoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;carbon monoxide;cobalt?

(4S)-3-[(2R,3R)-2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-3-ethyl-5-trimethylsilylpent-4-ynoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;carbon monoxide;cobalt has a molecular weight of 877.87 g/mol, XLogP of 6.25, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for (4S)-3-[(2R,3R)-2-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-3-ethyl-5-trimethylsilylpent-4-ynoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;carbon monoxide;cobalt is sourced from PubChem (CID 10876666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).