1-(beta-Hydroxy-2,3-dichlorophenethyl)-1-cyclobutyl-3-[4-(pivaloylaminomethyl)phenyl]urea

Base Information

• Chemical Name: 1-(beta-Hydroxy-2,3-dichlorophenethyl)-1-cyclobutyl-3-[4-(pivaloylaminomethyl)phenyl]urea
• CAS No.: 390406-55-0
• Molecular Formula: C25H31Cl2N3O3
• DSSTox Substance ID: DTXSID701105888
• Nikkaji Number: J1.620.490K
• ChEMBL ID: CHEMBL313644
• Mol file: 390406-55-0.mol

Synonyms:CHEMBL313644;SCHEMBL6928860;DAIONNVGZCMKCV-UHFFFAOYSA-N;DTXSID701105888;1-(beta-Hydroxy-2,3-dichlorophenethyl)-1-cyclobutyl-3-[4-(pivaloylaminomethyl)phenyl]urea;390406-55-0;N-(4-{3-[2-(2,3-Dichloro-phenyl)-2-hydroxy-ethyl]-3-cyclobutyl-ureido}-benzyl)-2,2-dimethyl-propionamide;N-[[4-[[[Cyclobutyl[2-(2,3-dichlorophenyl)-2-hydroxyethyl]amino]carbonyl]amino]phenyl]methyl]-2,2-dimethylpropanamide

Chemical Property of 1-(beta-Hydroxy-2,3-dichlorophenethyl)-1-cyclobutyl-3-[4-(pivaloylaminomethyl)phenyl]urea

Chemical Property:

• XLogP3: 4.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 491.1742472
• Heavy Atom Count: 33
• Complexity: 660

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MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C)C(=O)NCC1=CC=C(C=C1)NC(=O)N(CC(C2=C(C(=CC=C2)Cl)Cl)O)C3CCC3

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