N-(3-acetylphenyl)-4-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]benzene-1-sulfonamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-4-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]benzene-1-sulfonamide
N-(3-acetylphenyl)-4-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | G851-0037 |
| Compound Name: | N-(3-acetylphenyl)-4-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]benzene-1-sulfonamide |
| Molecular Weight: | 427.43 |
| Molecular Formula: | C20 H17 N3 O6 S |
| Smiles: | CC(c1cccc(c1)NS(c1ccc(/C=C/c2c(c(C)no2)[N+]([O-])=O)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6379 |
| logD: | 3.1548 |
| logSw: | -4.1608 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 109.01 |
| InChI Key: | RJNSMJYLGNXVKL-UHFFFAOYSA-N |