KP4PK5AQ6X
4-methyl-N-[2-(6-nitro-4-oxo-3,1-benzoxazin-2-yl)phenyl]benzenesulfonamide
Also Known As: N-(2-(6-(Hydroxy(oxido)amino)-4-oxo-4H-3,1-benzoxazin-2-yl)phenyl)-4-methylbenzenesulfonamide|4-[(4-methylphenyl)sulfonylamino]benzoic acid|4-methyl-N-[2-(6-nitro-4-oxo-3,1-benzoxazin-2-yl)phenyl]benzenesulfonamide|4-methyl-N-[2-(6-nitro-4-oxo-3,1-benzoxazin-2-yl)phenyl]benz|4-methyl-N-[2-(6-nitro-4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]benzene-1-sulfonamide|4-Methyl-N-[2-(6-nitro-4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]benzenesulfonamide|Benzenesulfonamide, 4-methyl-N-[2-(6-nitro-4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]-
| Molecular Formula | C21H15N3O6S |
|---|---|
| Molecular Weight | 437.06815 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 437.06815 |
| Monoisotopic Mass | 437.06815 |
| Heavy Atoms | 31 |
| Complexity | 825.0 |
Chemical Identifiers
| CAS Number | 37029-01-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C3=NC4=C(C=C(C=C4)[N+](=O)[O-])C(=O)O3 |
| InChIKey | PYLYZXBDFSKPBD-UHFFFAOYSA-N |
Product Overview
KP4PK5AQ6X (CAS 37029-01-9), with molecular formula C21H15N3O6S and molecular weight 437.06815 g/mol. IUPAC: 4-methyl-N-[2-(6-nitro-4-oxo-3,1-benzoxazin-2-yl)phenyl]benzenesulfonamide.
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