1,3,4-Oxadiazole,2,2'-(vinylenedi-p-phenylene)bis[5-(2-furyl)-(7CI,8CI)
N-[[4-(1,3-benzoxazol-2-yl)-3-hydroxyphenyl]carbamothioyl]-3-bromobenzamide
Also Known As: CCG-4631|AB00106921-01|1,3,4-Oxadiazole,2,2'-(vinylenedi-p-phenylene)bis[5-(2-furyl)- (7CI,8CI)|N-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)carbamothioyl)-3-bromobenzamide|N-{[4-(1,3-benzoxazol-2-yl)-3-hydroxyphenyl]carbamothioyl}-3-bromobenzamide|N-[[(4E)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxocyclohexa-1,5-dien-1-yl]carbamothioyl]-3-bromobenzamide|N-[[4-(3H-1,3-benzoxazol-2-ylidene)-3-oxocyclohexa-1,5-dien-1-yl]carbamothioyl]-3-bromobenzamide|N-[[4-(3H-benzooxazol-2-ylidene)-3-oxo-1-cyclohexa-1,5-dienyl]thiocarbamoyl]-3-bromo-benzamide
| Molecular Formula | C21H14BrN3O3S |
|---|---|
| Molecular Weight | 466.99393 g/mol |
| LogP | 5.0897 |
| Topological Polar Surface Area | 87.39 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 466.99393 |
| Monoisotopic Mass | 466.99393 |
| Heavy Atoms | 29 |
| Complexity | 1205.8137 |
Chemical Identifiers
| CAS Number | 428448-75-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(O2)C3=C(C=C(C=C3)NC(=S)NC(=O)C4=CC(=CC=C4)Br)O |
Product Overview
1,3,4-Oxadiazole,2,2'-(vinylenedi-p-phenylene)bis[5-(2-furyl)-(7CI,8CI) (CAS 428448-75-3), with molecular formula C21H14BrN3O3S and molecular weight 466.99393 g/mol. IUPAC: N-[[4-(1,3-benzoxazol-2-yl)-3-hydroxyphenyl]carbamothioyl]-3-bromobenzamide.