N-(3-acetyl-2-methyl-1-benzofuran-5-yl)-N-(3-nitrobenzene-1-sulfonyl)butanamide
Chemical Structure Depiction of
N-(3-acetyl-2-methyl-1-benzofuran-5-yl)-N-(3-nitrobenzene-1-sulfonyl)butanamide
N-(3-acetyl-2-methyl-1-benzofuran-5-yl)-N-(3-nitrobenzene-1-sulfonyl)butanamide
Compound characteristics
| Compound ID: | 3461-2918 |
| Compound Name: | N-(3-acetyl-2-methyl-1-benzofuran-5-yl)-N-(3-nitrobenzene-1-sulfonyl)butanamide |
| Molecular Weight: | 444.46 |
| Molecular Formula: | C21 H20 N2 O7 S |
| Smiles: | CCCC(N(c1ccc2c(c1)c(C(C)=O)c(C)o2)S(c1cccc(c1)[N+]([O-])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8779 |
| logD: | 3.8779 |
| logSw: | -4.1446 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 100.446 |
| InChI Key: | KZDUBDRAZZSFRJ-UHFFFAOYSA-N |