ethyl 4-{[2-(butylamino)-3,4-dioxocyclobut-1-en-1-yl]amino}piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{[2-(butylamino)-3,4-dioxocyclobut-1-en-1-yl]amino}piperidine-1-carboxylate
ethyl 4-{[2-(butylamino)-3,4-dioxocyclobut-1-en-1-yl]amino}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C748-0269 |
| Compound Name: | ethyl 4-{[2-(butylamino)-3,4-dioxocyclobut-1-en-1-yl]amino}piperidine-1-carboxylate |
| Molecular Weight: | 323.39 |
| Molecular Formula: | C16 H25 N3 O4 |
| Smiles: | CCCCNC1=C(C(C1=O)=O)NC1CCN(CC1)C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 1.6317 |
| logD: | 1.6308 |
| logSw: | -1.7924 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.54 |
| InChI Key: | UMYZWWHKHDWGTB-UHFFFAOYSA-N |