ethyl 4-{[2-({3-[ethyl(3-methylphenyl)amino]propyl}amino)-3,4-dioxocyclobut-1-en-1-yl]amino}piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{[2-({3-[ethyl(3-methylphenyl)amino]propyl}amino)-3,4-dioxocyclobut-1-en-1-yl]amino}piperidine-1-carboxylate
ethyl 4-{[2-({3-[ethyl(3-methylphenyl)amino]propyl}amino)-3,4-dioxocyclobut-1-en-1-yl]amino}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C748-0287 |
| Compound Name: | ethyl 4-{[2-({3-[ethyl(3-methylphenyl)amino]propyl}amino)-3,4-dioxocyclobut-1-en-1-yl]amino}piperidine-1-carboxylate |
| Molecular Weight: | 442.56 |
| Molecular Formula: | C24 H34 N4 O4 |
| Smiles: | CCN(CCCNC1=C(C(C1=O)=O)NC1CCN(CC1)C(=O)OCC)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.9679 |
| logD: | 2.9635 |
| logSw: | -3.1162 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.258 |
| InChI Key: | UNJDNLXMANBJAE-UHFFFAOYSA-N |