N-(3,4-dimethoxyphenyl)-2-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]acetamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-2-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]acetamide
N-(3,4-dimethoxyphenyl)-2-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]acetamide
Compound characteristics
| Compound ID: | K940-0390 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-2-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]acetamide |
| Molecular Weight: | 464.5 |
| Molecular Formula: | C20 H24 N4 O7 S |
| Smiles: | COc1ccc(cc1OC)NC(CN1CCN(CC1)S(c1cccc(c1)[N+]([O-])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1469 |
| logD: | 2.1468 |
| logSw: | -2.9965 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 107.282 |
| InChI Key: | LTNFBBHOHRFACZ-UHFFFAOYSA-N |