N-{2-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]ethyl}-2-methyl-3-nitrobenzamide
Chemical Structure Depiction of
N-{2-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]ethyl}-2-methyl-3-nitrobenzamide
N-{2-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]ethyl}-2-methyl-3-nitrobenzamide
Compound characteristics
| Compound ID: | G678-0501 |
| Compound Name: | N-{2-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]ethyl}-2-methyl-3-nitrobenzamide |
| Molecular Weight: | 462.52 |
| Molecular Formula: | C21 H26 N4 O6 S |
| Smiles: | Cc1c(cccc1[N+]([O-])=O)C(NCCS(N1CCN(CC1)c1ccccc1OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2361 |
| logD: | 2.2361 |
| logSw: | -2.9335 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.04 |
| InChI Key: | IWZVGIJCNYULCK-UHFFFAOYSA-N |