N-(2,6-difluorophenyl)-4-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-4-oxobutanamide
Chemical Structure Depiction of
N-(2,6-difluorophenyl)-4-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-4-oxobutanamide
N-(2,6-difluorophenyl)-4-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-4-oxobutanamide
Compound characteristics
| Compound ID: | IB05-3667 |
| Compound Name: | N-(2,6-difluorophenyl)-4-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-4-oxobutanamide |
| Molecular Weight: | 455.45 |
| Molecular Formula: | C20 H20 F3 N3 O4 S |
| Smiles: | C(CC(N1CCN(CC1)S(c1ccc(cc1)F)(=O)=O)=O)C(Nc1c(cccc1F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7 |
| logD: | 1.68 |
| logSw: | -2.98 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 126.22 |
| InChI Key: | HUQPWLTZSGJAHH-UHFFFAOYSA-N |