2-(4-tert-butylphenoxy)-1-{4-[3-(cyclopropylamino)-4-nitrophenyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-tert-butylphenoxy)-1-{4-[3-(cyclopropylamino)-4-nitrophenyl]piperazin-1-yl}ethan-1-one
2-(4-tert-butylphenoxy)-1-{4-[3-(cyclopropylamino)-4-nitrophenyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | 8012-1099 |
| Compound Name: | 2-(4-tert-butylphenoxy)-1-{4-[3-(cyclopropylamino)-4-nitrophenyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 452.55 |
| Molecular Formula: | C25 H32 N4 O4 |
| Smiles: | CC(C)(C)c1ccc(cc1)OCC(N1CCN(CC1)c1ccc(c(c1)NC1CC1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6152 |
| logD: | 4.6152 |
| logSw: | -4.4771 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.793 |
| InChI Key: | ULRARJXDKUJHHF-UHFFFAOYSA-N |