AC1LQ6PS
2-methyl-N-[[4-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-3-nitrobenzamide
Also Known As: Oprea1_224218|AB00111230-01|2-methyl-N-[[4-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-3-nitrobenzamide|2-methyl-N-{[4-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-3-nitrobenzamide|2-methyl-N-[[4-(6-methylbenzooxazol-2-yl)phenyl]thiocarbamoyl]-3-nitro-benzamide
CAS: 429643-64-1
| Molecular Formula | C23H18N4O4S |
|---|---|
| Molecular Weight | 446.1049 g/mol |
| LogP | 5.14664 |
| Topological Polar Surface Area | 110.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 446.1049 |
| Monoisotopic Mass | 446.1049 |
| Heavy Atoms | 32 |
| Complexity | 1362.4415 |
Chemical Identifiers
| CAS Number | 429643-64-1 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(O2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=C(C(=CC=C4)[N+](=O)[O-])C |
Product Overview
AC1LQ6PS (CAS 429643-64-1), with molecular formula C23H18N4O4S and molecular weight 446.1049 g/mol. IUPAC: 2-methyl-N-[[4-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-3-nitrobenzamide.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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