N-(5-((4-(2,4-Bis(1,1-dimethylpropyl)phenoxy)-1-oxobutyl)amino)-2-chlorophenyl)-4,4-dimethyl-3-oxo-2-(4-((4-(phenylmethoxy)phenyl)sulphonyl)phenoxy)valeramide

Base Information

• Chemical Name: N-(5-((4-(2,4-Bis(1,1-dimethylpropyl)phenoxy)-1-oxobutyl)amino)-2-chlorophenyl)-4,4-dimethyl-3-oxo-2-(4-((4-(phenylmethoxy)phenyl)sulphonyl)phenoxy)valeramide
• CAS No.: 30744-85-5
• Deprecated CAS: 75774-51-5
• Molecular Formula: C52H61ClN2O8S
• Molecular Weight: 909.57
• European Community (EC) Number: 250-321-7
• DSSTox Substance ID: DTXSID80865558
• Nikkaji Number: J287.388E
• Mol file: 30744-85-5.mol

Synonyms:30744-85-5;EINECS 250-321-7;N-(5-((4-(2,4-Bis(1,1-dimethylpropyl)phenoxy)-1-oxobutyl)amino)-2-chlorophenyl)-4,4-dimethyl-3-oxo-2-(4-((4-(phenylmethoxy)phenyl)sulphonyl)phenoxy)valeramide;N-[5-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoylamino]-2-chlorophenyl]-4,4-dimethyl-3-oxo-2-[4-(4-phenylmethoxyphenyl)sulfonylphenoxy]pentanamide;Pentanamide, N-[5-[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]-4,4-dimethyl-3-oxo-2-[4-[[4-(phenylmethoxy)phenyl]sulfonyl]phenoxy]-;N-[5-[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]-4,4-dimethyl-3-oxo-2-[4-[[4-(phenylmethoxy)phenyl]sulphonyl]phenoxy]valeramide;Pentanamide, N-(5-((4-(2,4-bis(1,1-dimethylpropyl)phenoxy)-1-oxobutyl)amino)-2-chlorophenyl)-4,4-dimethyl-3-oxo-2-(4-((4-(phenylmethoxy)phenyl)sulfonyl)phenoxy)-;C52H61ClN2O8S;SCHEMBL7200697;DTXSID80865558;C52-H61-Cl-N2-O8-S;AKOS015888841;FT-0654382;A820596;W-109212;2-(4-(4-(benzyloxy)phenylsulfonyl)phenoxy)-N-(2-chloro-5-(4-(2,4-di-tert-pentylphenoxy)butanamido)phenyl)-4,4-dimethyl-3-oxopentanamide;2-(4-{[4-(benzyloxy)phenyl]sulfonyl}phenoxy)-N-(2-chloro-5-{[4-(2,4-ditert-pentylphenoxy)butanoyl]amino}phenyl)-4,4-dimethyl-3-oxopentanamide;2-[4-(4-Benzyloxy-diphenyl-sulfonyl-pheoxy)]-4,4-dimethyl-3-oxo-pentanoic acid-[2-chlor-5-[4-(2,4-di-ter-pentylphenoxy)-butyramido]]-anilide;N-[5-[[4-[2,4-bis(1,1-Dimethylpropyl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]-4,4-dimethyl-3-oxo-2-[4-[[4-(phenylmethoxy)phenyl]su lphonyl]phenoxy]valeramide;N-[5-[[4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]-4,4-dimethyl-3-oxo-2-[4-[[4-(phenylmethoxy)phenyl]sulfonyl]phenoxy]pentanamide;N-[5-[[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]-4,4-dimethyl-3-oxo-2-[4-(4-phenylmethoxyphenyl)sulfonylphenoxy]pentanamide;N-[5-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoylamino]-2-chloranyl-phenyl]-4,4-dimethyl-3-oxidanylidene-2-[4-(4-phenylmethoxyphenyl)sulfonylphenoxy]pentanamide;Pentanamide, N-[5-[[4-[2,4-bis(1,1-dimethylpropyl) phenoxy]-1-oxobutyl]amino]-2-chlorophenyl ]-4,4-dimethyl-3-oxo-2-[4-[[4-(phenylmethoxy)pheny l]sulfonyl]phenoxy]-

Chemical Property of N-(5-((4-(2,4-Bis(1,1-dimethylpropyl)phenoxy)-1-oxobutyl)amino)-2-chlorophenyl)-4,4-dimethyl-3-oxo-2-(4-((4-(phenylmethoxy)phenyl)sulphonyl)phenoxy)valeramide

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.585
• Boiling Point: 988.2 °C at 760 mmHg
• Flash Point: 551.4 °C
• PSA: 145.48000
• Density: 1.201 g/cm³
• LogP: 13.15280
• XLogP3: 13.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 21
• Exact Mass: 908.3837158
• Heavy Atom Count: 64
• Complexity: 1590

Purity/Quality:

99% ^*data from raw suppliers

BENZYLOXYPHENYLSULFONYLPHENOXY-CL-DI-T-PEN-PHO-BUTYRAM-PH-DIME-OXOPENTANAM 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)NC(=O)C(C(=O)C(C)(C)C)OC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)OCC5=CC=CC=C5)C(C)(C)CC