N-{[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-2-phenylacetamide

Base Information

• Chemical Name: N-{[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-2-phenylacetamide
• CAS No.: 590395-14-5
• Molecular Formula: C24H20ClN3O2S
• Molecular Weight: 449.9525
• DSSTox Substance ID: DTXSID40405414
• Wikidata: Q82209955
• Mol file: 590395-14-5.mol

Synonyms:590395-14-5;N-{[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-2-phenylacetamide;DTXSID40405414;AKOS002340737;N-((4-Chloro-3-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-2-phenylacetamide

Chemical Property of N-{[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-2-phenylacetamide

Chemical Property:

• PSA: 109.78000
• LogP: 6.88150
• XLogP3: 6.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 449.0964758
• Heavy Atom Count: 31
• Complexity: 644

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C2C(=C1)N=C(O2)C3=C(C=CC(=C3)NC(=S)NC(=O)CC4=CC=CC=C4)Cl)C

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