Benzoic acid, 4-chloro-3-((2-(4-ethoxy-2,5-dioxo-3-(phenylmethyl)-1-imidazolidinyl)-3-(4-methoxyphenyl)-1,3-dioxopropyl)amino)-, dodecyl ester

Base Information

• Chemical Name: Benzoic acid, 4-chloro-3-((2-(4-ethoxy-2,5-dioxo-3-(phenylmethyl)-1-imidazolidinyl)-3-(4-methoxyphenyl)-1,3-dioxopropyl)amino)-, dodecyl ester
• CAS No.: 70950-45-7
• Molecular Formula: C41H50ClN3O8
• Molecular Weight: 748.32
• European Community (EC) Number: 403-990-6,615-216-6
• DSSTox Substance ID: DTXSID30887765
• Nikkaji Number: J38.423B
• Mol file: 70950-45-7.mol

Synonyms:70950-45-7;EC 403-990-6;Benzoic acid, 4-chloro-3-((2-(4-ethoxy-2,5-dioxo-3-(phenylmethyl)-1-imidazolidinyl)-3-(4-methoxyphenyl)-1,3-dioxopropyl)amino)-, dodecyl ester;dodecyl 3-[[2-(3-benzyl-4-ethoxy-2,5-dioxoimidazolidin-1-yl)-3-(4-methoxyphenyl)-3-oxopropanoyl]amino]-4-chlorobenzoate;Benzoic acid, 4-chloro-3-[[2-[4-ethoxy-2,5-dioxo-3-(phenylmethyl)-1-imidazolidinyl]-3-(4-methoxyphenyl)-1,3-dioxopropyl]amino]-, dodecyl ester;dodecyl 3-(2-(3-benzyl-4-ethoxy-2,5-dioxoimidazolidin-1-yl)-3-(4-methoxybenzoyl)acetamido)-4-chlorobenzoate;Benzoic acid,4-chloro-3-[[2-[4-ethoxy-2,5-dioxo-3-(phenylmethyl)-1-imidazolidinyl]-3-(4-methoxyphenyl)-1,3-dioxopropyl]amino]-, dodecyl ester;SCHEMBL7758601;DTXSID30887765;FT-0653034;|A-(4-Methoxybezoyl)-|A-(1-benzyl-5-ethoxy-3-hydantoin)-2-chloro-5-dodecyloxycarbonyl acetanilide;alpha-(1-Benzyl-5-ethoxyhydantoin-3-yl)-2'-chloro-5'-dodecyloxycarbonyl-alpha-(4-methoxybenzoyl)acetanilide;alpha-(4-Methoxybenzoyl)-alpha-(1-benzyl-5-ethoxyhydantion)-2-chloro-5-dodecyloxycarbonylacetanilide;Benzoic acid, 4-chloro-3-((2-(4-ethoxy-2,5-dioxo-3-(phenylmethyl)-1-imidazolidinyl)-3-(4-metho

Chemical Property of Benzoic acid, 4-chloro-3-((2-(4-ethoxy-2,5-dioxo-3-(phenylmethyl)-1-imidazolidinyl)-3-(4-methoxyphenyl)-1,3-dioxopropyl)amino)-, dodecyl ester

Chemical Property:

• Melting Point: 82-87 ºC
• Refractive Index: 1.596
• PKA: 9.17±0.40(Predicted)
• PSA: 131.55000
• Density: 1.25 g/cm³
• LogP: 8.39210
• XLogP3: 10.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 23
• Exact Mass: 747.3286433
• Heavy Atom Count: 53
• Complexity: 1170

Purity/Quality:

99% ^*data from raw suppliers

ALPHA-(4-METHOXYBENZOYL)-ALPHA-(1-BENZYL-5-ETHOXY-3-HYDANTOINYL)-2-CHLORO-5-DODECYLOXYCARBONYLACETANILIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R53:
• Hazard Codes: R53:
• Statements: 53
• Safety Statements: 61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)C2=CC=C(C=C2)OC)N3C(=O)C(N(C3=O)CC4=CC=CC=C4)OCC