ethyl 4-[(3,4-dioxo-2-{[(pyridin-3-yl)methyl]amino}cyclobut-1-en-1-yl)amino]piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[(3,4-dioxo-2-{[(pyridin-3-yl)methyl]amino}cyclobut-1-en-1-yl)amino]piperidine-1-carboxylate
ethyl 4-[(3,4-dioxo-2-{[(pyridin-3-yl)methyl]amino}cyclobut-1-en-1-yl)amino]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C748-0027 |
| Compound Name: | ethyl 4-[(3,4-dioxo-2-{[(pyridin-3-yl)methyl]amino}cyclobut-1-en-1-yl)amino]piperidine-1-carboxylate |
| Molecular Weight: | 358.4 |
| Molecular Formula: | C18 H22 N4 O4 |
| Smiles: | CCOC(N1CCC(CC1)NC1=C(C(C1=O)=O)NCc1cccnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4199 |
| logD: | 0.4184 |
| logSw: | -1.0164 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.945 |
| InChI Key: | WFECWKCNTKWZCB-UHFFFAOYSA-N |