4,5-dimethoxy-N-[4-(4-methylpiperidine-1-sulfonyl)phenyl]-2-nitrobenzamide
Chemical Structure Depiction of
4,5-dimethoxy-N-[4-(4-methylpiperidine-1-sulfonyl)phenyl]-2-nitrobenzamide
4,5-dimethoxy-N-[4-(4-methylpiperidine-1-sulfonyl)phenyl]-2-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-2601 |
| Compound Name: | 4,5-dimethoxy-N-[4-(4-methylpiperidine-1-sulfonyl)phenyl]-2-nitrobenzamide |
| Molecular Weight: | 463.51 |
| Molecular Formula: | C21 H25 N3 O7 S |
| Smiles: | CC1CCN(CC1)S(c1ccc(cc1)NC(c1cc(c(cc1[N+]([O-])=O)OC)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1129 |
| logD: | 2.7192 |
| logSw: | -3.7633 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.382 |
| InChI Key: | PYYHHTZTWKBWEH-UHFFFAOYSA-N |