1-{4-[4-(1-{5-[2-(2,4-difluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carbonyl)piperazin-1-yl]phenyl}ethan-1-one
Chemical Structure Depiction of
1-{4-[4-(1-{5-[2-(2,4-difluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carbonyl)piperazin-1-yl]phenyl}ethan-1-one
1-{4-[4-(1-{5-[2-(2,4-difluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carbonyl)piperazin-1-yl]phenyl}ethan-1-one
Compound characteristics
| Compound ID: | G637-3513 |
| Compound Name: | 1-{4-[4-(1-{5-[2-(2,4-difluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carbonyl)piperazin-1-yl]phenyl}ethan-1-one |
| Molecular Weight: | 598.67 |
| Molecular Formula: | C30 H32 F2 N4 O5 S |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)C(C1CCN(CC1)S(c1c(C)noc1/C=C/c1ccc(cc1F)F)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6519 |
| logD: | 3.6519 |
| logSw: | -3.9198 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.2 |
| InChI Key: | FXOJXYZBQSMXKE-UHFFFAOYSA-N |