N-(2-benzyl-1,3-benzoxazol-5-yl)-4-nitrobenzamide

Base Information

• Chemical Name: N-(2-benzyl-1,3-benzoxazol-5-yl)-4-nitrobenzamide
• CAS No.: 785836-59-1
• Molecular Formula: C21H15N3O4
• Molecular Weight: 373.36200
• DSSTox Substance ID: DTXSID30388444
• Wikidata: Q82183424
• ChEMBL ID: CHEMBL244058
• Mol file: 785836-59-1.mol

Synonyms:785836-59-1;N-(2-benzylbenzo[d]oxazol-5-yl)-4-nitrobenzamide;N-(2-benzyl-1,3-benzoxazol-5-yl)-4-nitrobenzamide;CHEMBL244058;DTXSID30388444;N-(2-Benzyl-benzooxazol-5-yl)-4-nitro-benzamide;N-(2-benzyl-1,3-benzoxazol-5-yl)-4-nitro-benzamide

Chemical Property of N-(2-benzyl-1,3-benzoxazol-5-yl)-4-nitrobenzamide

Chemical Property:

• PSA: 100.95000
• LogP: 5.17530
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 373.10625597
• Heavy Atom Count: 28
• Complexity: 552

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CC2=NC3=C(O2)C=CC(=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]