ethyl 4-[(2-{[(2-chlorophenyl)methyl]amino}-3,4-dioxocyclobut-1-en-1-yl)amino]piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[(2-{[(2-chlorophenyl)methyl]amino}-3,4-dioxocyclobut-1-en-1-yl)amino]piperidine-1-carboxylate
ethyl 4-[(2-{[(2-chlorophenyl)methyl]amino}-3,4-dioxocyclobut-1-en-1-yl)amino]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C748-0045 |
| Compound Name: | ethyl 4-[(2-{[(2-chlorophenyl)methyl]amino}-3,4-dioxocyclobut-1-en-1-yl)amino]piperidine-1-carboxylate |
| Molecular Weight: | 391.85 |
| Molecular Formula: | C19 H22 Cl N3 O4 |
| Smiles: | CCOC(N1CCC(CC1)NC1=C(C(C1=O)=O)NCc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.4296 |
| logD: | 2.4214 |
| logSw: | -3.1178 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.427 |
| InChI Key: | QHSJJFAOOAXYDR-UHFFFAOYSA-N |