N-{2-[4-(4-methoxyphenyl)piperazine-1-sulfonyl]ethyl}-4-methyl-3-nitrobenzamide
Chemical Structure Depiction of
N-{2-[4-(4-methoxyphenyl)piperazine-1-sulfonyl]ethyl}-4-methyl-3-nitrobenzamide
N-{2-[4-(4-methoxyphenyl)piperazine-1-sulfonyl]ethyl}-4-methyl-3-nitrobenzamide
Compound characteristics
| Compound ID: | G678-0394 |
| Compound Name: | N-{2-[4-(4-methoxyphenyl)piperazine-1-sulfonyl]ethyl}-4-methyl-3-nitrobenzamide |
| Molecular Weight: | 462.52 |
| Molecular Formula: | C21 H26 N4 O6 S |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C(NCCS(N1CCN(CC1)c1ccc(cc1)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1488 |
| logD: | 2.1488 |
| logSw: | -2.8899 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.255 |
| InChI Key: | CMOADKIPECKPNJ-UHFFFAOYSA-N |