AC1LQ3ZA
N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-1-benzofuran-2-carboxamide
Also Known As: Oprea1_052036|SR-01000474551-1|3-(1-BENZOFURAN-2-CARBONYL)-1-[3-(1,3-BENZOXAZOL-2-YL)-2-METHYLPHENYL]THIOUREA|N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-1-benzofuran-2-carboxamide|N-((3-(benzo[d]oxazol-2-yl)-2-methylphenyl)carbamothioyl)benzofuran-2-carboxamide|N-[(3-benzooxazol-2-yl-2-methyl-phenyl)thiocarbamoyl]benzofuran-2-carboxamide|N-{[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl}-1-benzofuran-2-carboxamide
| Molecular Formula | C24H17N3O3S |
|---|---|
| Molecular Weight | 427.09906 g/mol |
| LogP | 5.67622 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 427.09906 |
| Monoisotopic Mass | 427.09906 |
| Heavy Atoms | 31 |
| Complexity | 1385.0614 |
Chemical Identifiers
| CAS Number | 428852-41-9 |
|---|---|
| SMILES | CC1=C(C=CC=C1NC(=S)NC(=O)C2=CC3=CC=CC=C3O2)C4=NC5=CC=CC=C5O4 |
Product Overview
AC1LQ3ZA (CAS 428852-41-9), with molecular formula C24H17N3O3S and molecular weight 427.09906 g/mol. IUPAC: N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-1-benzofuran-2-carboxamide.
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