3-(4-methylbenzene-1-sulfonyl)-N-(3-nitrophenyl)propanamide
Chemical Structure Depiction of
3-(4-methylbenzene-1-sulfonyl)-N-(3-nitrophenyl)propanamide
3-(4-methylbenzene-1-sulfonyl)-N-(3-nitrophenyl)propanamide
Compound characteristics
| Compound ID: | K978-0585 |
| Compound Name: | 3-(4-methylbenzene-1-sulfonyl)-N-(3-nitrophenyl)propanamide |
| Molecular Weight: | 348.38 |
| Molecular Formula: | C16 H16 N2 O5 S |
| Smiles: | Cc1ccc(cc1)S(CCC(Nc1cccc(c1)[N+]([O-])=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7514 |
| logD: | 2.7437 |
| logSw: | -3.3831 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.534 |
| InChI Key: | GLKSTKBJIBVKEJ-UHFFFAOYSA-N |