ethyl 4-{2-[({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)amino]-3,4-dioxocyclobut-1-en-1-yl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{2-[({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)amino]-3,4-dioxocyclobut-1-en-1-yl}piperazine-1-carboxylate
ethyl 4-{2-[({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)amino]-3,4-dioxocyclobut-1-en-1-yl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | C748-1397 |
| Compound Name: | ethyl 4-{2-[({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)amino]-3,4-dioxocyclobut-1-en-1-yl}piperazine-1-carboxylate |
| Molecular Weight: | 454.57 |
| Molecular Formula: | C25 H34 N4 O4 |
| Smiles: | CCOC(N1CCN(CC1)C1=C(C(C1=O)=O)NCC1CCN(CC1)Cc1cccc(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3637 |
| logD: | 0.8713 |
| logSw: | -3.4205 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.371 |
| InChI Key: | OYEUNDSZJSZTCY-UHFFFAOYSA-N |