ethyl 4-{2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]-3,4-dioxocyclobut-1-en-1-yl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]-3,4-dioxocyclobut-1-en-1-yl}piperazine-1-carboxylate
ethyl 4-{2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]-3,4-dioxocyclobut-1-en-1-yl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | C748-1298 |
| Compound Name: | ethyl 4-{2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]-3,4-dioxocyclobut-1-en-1-yl}piperazine-1-carboxylate |
| Molecular Weight: | 426.51 |
| Molecular Formula: | C23 H30 N4 O4 |
| Smiles: | CCOC(N1CCN(CC1)C1=C(C(C1=O)=O)N1CCN(C(C)C1)c1ccc(C)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2754 |
| logD: | 3.2749 |
| logSw: | -3.2146 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.055 |
| InChI Key: | PYFQBSYPMCGMAQ-KRWDZBQOSA-N |