N-benzyl-N-ethyl-4-({[2-(4-methylpiperidin-1-yl)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-benzyl-N-ethyl-4-({[2-(4-methylpiperidin-1-yl)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)cyclohexane-1-carboxamide
N-benzyl-N-ethyl-4-({[2-(4-methylpiperidin-1-yl)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | C906-0581 |
| Compound Name: | N-benzyl-N-ethyl-4-({[2-(4-methylpiperidin-1-yl)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)cyclohexane-1-carboxamide |
| Molecular Weight: | 451.61 |
| Molecular Formula: | C27 H37 N3 O3 |
| Smiles: | CCN(Cc1ccccc1)C(C1CCC(CC1)CNC1=C(C(C1=O)=O)N1CCC(C)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4159 |
| logD: | 4.4155 |
| logSw: | -4.1597 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.987 |
| InChI Key: | GQWSZUMGNFCXDB-UHFFFAOYSA-N |