N-(3,5-dimethylphenyl)-2-methyl-5-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]benzene-1-sulfonamide
Chemical Structure Depiction of
N-(3,5-dimethylphenyl)-2-methyl-5-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]benzene-1-sulfonamide
N-(3,5-dimethylphenyl)-2-methyl-5-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | G851-0096 |
| Compound Name: | N-(3,5-dimethylphenyl)-2-methyl-5-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]benzene-1-sulfonamide |
| Molecular Weight: | 427.48 |
| Molecular Formula: | C21 H21 N3 O5 S |
| Smiles: | Cc1cc(C)cc(c1)NS(c1cc(/C=C/c2c(c(C)no2)[N+]([O-])=O)ccc1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9582 |
| logD: | 4.9227 |
| logSw: | -4.7364 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.183 |
| InChI Key: | YMIBIGKHYIAMBP-UHFFFAOYSA-N |