N-(3-acetyl-2-methyl-1-benzofuran-5-yl)-N-(4-methyl-3-nitrobenzene-1-sulfonyl)butanamide
Chemical Structure Depiction of
N-(3-acetyl-2-methyl-1-benzofuran-5-yl)-N-(4-methyl-3-nitrobenzene-1-sulfonyl)butanamide
N-(3-acetyl-2-methyl-1-benzofuran-5-yl)-N-(4-methyl-3-nitrobenzene-1-sulfonyl)butanamide
Compound characteristics
| Compound ID: | 5591-3786 |
| Compound Name: | N-(3-acetyl-2-methyl-1-benzofuran-5-yl)-N-(4-methyl-3-nitrobenzene-1-sulfonyl)butanamide |
| Molecular Weight: | 458.49 |
| Molecular Formula: | C22 H22 N2 O7 S |
| Smiles: | CCCC(N(c1ccc2c(c1)c(C(C)=O)c(C)o2)S(c1ccc(C)c(c1)[N+]([O-])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5879 |
| logD: | 4.5879 |
| logSw: | -4.6318 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 100.145 |
| InChI Key: | SLVJAHJLTWBVTK-UHFFFAOYSA-N |