ethyl 1-{2-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-3,4-dioxocyclobut-1-en-1-yl}piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{2-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-3,4-dioxocyclobut-1-en-1-yl}piperidine-3-carboxylate
ethyl 1-{2-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-3,4-dioxocyclobut-1-en-1-yl}piperidine-3-carboxylate
Compound characteristics
| Compound ID: | C738-0116 |
| Compound Name: | ethyl 1-{2-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-3,4-dioxocyclobut-1-en-1-yl}piperidine-3-carboxylate |
| Molecular Weight: | 425.53 |
| Molecular Formula: | C24 H31 N3 O4 |
| Smiles: | CCOC(C1CCCN(C1)C1=C(C(C1=O)=O)N1CCN(C(C)C1)c1cccc(C)c1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7154 |
| logD: | 3.7153 |
| logSw: | -3.8108 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.962 |
| InChI Key: | VRIPOINWQOSWLJ-UHFFFAOYSA-N |