ethyl 4-{4-[2-(2,5-dioxopyrrolidin-1-yl)ethanesulfonyl]-3,5,6-trifluoropyridin-2-yl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{4-[2-(2,5-dioxopyrrolidin-1-yl)ethanesulfonyl]-3,5,6-trifluoropyridin-2-yl}piperazine-1-carboxylate
ethyl 4-{4-[2-(2,5-dioxopyrrolidin-1-yl)ethanesulfonyl]-3,5,6-trifluoropyridin-2-yl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | 8610-0484 |
| Compound Name: | ethyl 4-{4-[2-(2,5-dioxopyrrolidin-1-yl)ethanesulfonyl]-3,5,6-trifluoropyridin-2-yl}piperazine-1-carboxylate |
| Molecular Weight: | 478.45 |
| Molecular Formula: | C18 H21 F3 N4 O6 S |
| Smiles: | CCOC(N1CCN(CC1)c1c(c(c(c(n1)F)F)S(CCN1C(CCC1=O)=O)(=O)=O)F)=O |
| Stereo: | ACHIRAL |
| logP: | 0.929 |
| logD: | 0.929 |
| logSw: | -1.5289 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 96.766 |
| InChI Key: | BHEDMHJANMNZOF-UHFFFAOYSA-N |