3-methyl-N-[4-(4-methylpiperidine-1-sulfonyl)phenyl]-2-nitrobenzamide
Chemical Structure Depiction of
3-methyl-N-[4-(4-methylpiperidine-1-sulfonyl)phenyl]-2-nitrobenzamide
3-methyl-N-[4-(4-methylpiperidine-1-sulfonyl)phenyl]-2-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-3275 |
| Compound Name: | 3-methyl-N-[4-(4-methylpiperidine-1-sulfonyl)phenyl]-2-nitrobenzamide |
| Molecular Weight: | 417.48 |
| Molecular Formula: | C20 H23 N3 O5 S |
| Smiles: | CC1CCN(CC1)S(c1ccc(cc1)NC(c1cccc(C)c1[N+]([O-])=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.928 |
| logD: | 2.2989 |
| logSw: | -4.1528 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.82 |
| InChI Key: | RTBJJYGSGJDGFF-UHFFFAOYSA-N |