4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-(2-ethoxyacetyl)-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;2-ethoxyacetyl chloride

C54H59Cl5N6O12 — CID 167645259

About 4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-(2-ethoxyacetyl)-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;2-ethoxyacetyl chloride

4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-(2-ethoxyacetyl)-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;2-ethoxyacetyl chloride (PubChem CID 167645259) has the molecular formula C54H59Cl5N6O12 and a molecular weight of 1161.36 g/mol. Its IUPAC name is 4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-(2-ethoxyacetyl)-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;2-ethoxyacetyl chloride.

Molecular Properties

• Compound Name: 4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-(2-ethoxyacetyl)-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;2-ethoxyacetyl chloride
• PubChem CID: 167645259
• Molecular Formula: C54H59Cl5N6O12
• Molecular Weight: 1161.36 g/mol
• Exact Mass: 1158.26
• IUPAC Name: 4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-(2-ethoxyacetyl)-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;2-ethoxyacetyl chloride
• SMILES: CCN1OC[C@@H](NC(=O)c2ccc(C3=NOC(C)(c4cc(Cl)cc(Cl)c4)C3)cc2C)C1=O.CCOCC(=O)Cl.CCOCC(=O)N(C(=O)c1ccc(C2=NOC(C)(c3cc(Cl)cc(Cl)c3)C2)cc1C)[C@@H]1CON(CC)C1=O
• InChI: InChI=1S/C27H29Cl2N3O6.C23H23Cl2N3O4.C4H7ClO2/c1-5-31-26(35)23(14-37-31)32(24(33)15-36-6-2)25(34)21-8-7-17(9-16(21)3)22-13-27(4,38-30-22)18-10-19(28)12-20(29)11-18;1-4-28-22(30)20(12-31-28)26-21(29)18-6-5-14(7-13(18)2)19-11-23(3,32-27-19)15-8-16(24)10-17(25)9-15;1-2-7-3-4(5)6/h7-12,23H,5-6,13-15H2,1-4H3;5-10,20H,4,11-12H2,1-3H3,(H,26,29);2-3H2,1H3/t23-,27?;20-,23?;/m11./s1
• InChIKey: PTUNQJHOTBFUJS-CNNQOVLVSA-N
• XLogP: 9.53
• TPSA: 204.27 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 14
• Rotatable Bonds: 16
• Heavy Atoms: 77
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1161.36
LogP ≤ 5	9.53
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-(2-ethoxyacetyl)-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;2-ethoxyacetyl chloride?

The IUPAC name of 4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-(2-ethoxyacetyl)-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;2-ethoxyacetyl chloride (CID 167645259) is 4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-(2-ethoxyacetyl)-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;2-ethoxyacetyl chloride.

What is the SMILES notation for 4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-(2-ethoxyacetyl)-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;2-ethoxyacetyl chloride?

The canonical SMILES for 4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-(2-ethoxyacetyl)-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;2-ethoxyacetyl chloride is CCN1OC[C@@H](NC(=O)c2ccc(C3=NOC(C)(c4cc(Cl)cc(Cl)c4)C3)cc2C)C1=O.CCOCC(=O)Cl.CCOCC(=O)N(C(=O)c1ccc(C2=NOC(C)(c3cc(Cl)cc(Cl)c3)C2)cc1C)[C@@H]1CON(CC)C1=O.

What is the InChIKey of 4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-(2-ethoxyacetyl)-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;2-ethoxyacetyl chloride?

The InChIKey is PTUNQJHOTBFUJS-CNNQOVLVSA-N. The full InChI is InChI=1S/C27H29Cl2N3O6.C23H23Cl2N3O4.C4H7ClO2/c1-5-31-26(35)23(14-37-31)32(24(33)15-36-6-2)25(34)21-8-7-17(9-16(21)3)22-13-27(4,38-30-22)18-10-19(28)12-20(29)11-18;1-4-28-22(30)20(12-31-28)26-21(29)18-6-5-14(7-13(18)2)19-11-23(3,32-27-19)15-8-16(24)10-17(25)9-15;1-2-7-3-4(5)6/h7-12,23H,5-6,13-15H2,1-4H3;5-10,20H,4,11-12H2,1-3H3,(H,26,29);2-3H2,1H3/t23-,27?;20-,23?;/m11./s1.

What are the key properties of 4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-(2-ethoxyacetyl)-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;2-ethoxyacetyl chloride?

4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-(2-ethoxyacetyl)-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;2-ethoxyacetyl chloride has a molecular weight of 1161.36 g/mol, XLogP of 9.53, 16 rotatable bonds, 1 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-(2-ethoxyacetyl)-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-oxazol-3-yl]-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide;2-ethoxyacetyl chloride is sourced from PubChem (CID 167645259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).