2-(4-tert-butylphenoxy)-1-[4-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-nitrophenyl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(4-tert-butylphenoxy)-1-[4-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-nitrophenyl)piperazin-1-yl]ethan-1-one
2-(4-tert-butylphenoxy)-1-[4-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-nitrophenyl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | 3953-1380 |
| Compound Name: | 2-(4-tert-butylphenoxy)-1-[4-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-nitrophenyl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 576.69 |
| Molecular Formula: | C32 H40 N4 O6 |
| Smiles: | CC(C)(C)c1ccc(cc1)OCC(N1CCN(CC1)c1ccc(c(c1)NCCc1ccc(c(c1)OC)OC)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1918 |
| logD: | 5.1918 |
| logSw: | -5.0908 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.839 |
| InChI Key: | CDOHKOSKDSHEJY-UHFFFAOYSA-N |