N-(4-ethoxyphenyl)-3-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]propanamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-3-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]propanamide
N-(4-ethoxyphenyl)-3-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]propanamide
Compound characteristics
| Compound ID: | K940-0431 |
| Compound Name: | N-(4-ethoxyphenyl)-3-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]propanamide |
| Molecular Weight: | 462.52 |
| Molecular Formula: | C21 H26 N4 O6 S |
| Smiles: | CCOc1ccc(cc1)NC(CCN1CCN(CC1)S(c1cccc(c1)[N+]([O-])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5188 |
| logD: | 2.5158 |
| logSw: | -3.0237 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.123 |
| InChI Key: | RXCIXBBATMHDGH-UHFFFAOYSA-N |