4-({[3,4-dioxo-2-(piperidin-1-yl)cyclobut-1-en-1-yl]amino}methyl)-N-[(4-fluorophenyl)methyl]cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-({[3,4-dioxo-2-(piperidin-1-yl)cyclobut-1-en-1-yl]amino}methyl)-N-[(4-fluorophenyl)methyl]cyclohexane-1-carboxamide
4-({[3,4-dioxo-2-(piperidin-1-yl)cyclobut-1-en-1-yl]amino}methyl)-N-[(4-fluorophenyl)methyl]cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | C906-0943 |
| Compound Name: | 4-({[3,4-dioxo-2-(piperidin-1-yl)cyclobut-1-en-1-yl]amino}methyl)-N-[(4-fluorophenyl)methyl]cyclohexane-1-carboxamide |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C24 H30 F N3 O3 |
| Smiles: | C1CCN(CC1)C1=C(C(C1=O)=O)NCC1CCC(CC1)C(NCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2815 |
| logD: | 3.2811 |
| logSw: | -3.2979 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.464 |
| InChI Key: | DMCSSCOTTIRYQQ-UHFFFAOYSA-N |