3-chloro-N-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4-methoxy-N-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
3-chloro-N-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4-methoxy-N-methylbenzene-1-sulfonamide
3-chloro-N-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4-methoxy-N-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y050-0115 |
| Compound Name: | 3-chloro-N-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4-methoxy-N-methylbenzene-1-sulfonamide |
| Molecular Weight: | 455.93 |
| Molecular Formula: | C20 H23 Cl F N3 O4 S |
| Smiles: | CN(CC(N1CCN(CC1)c1ccc(cc1)F)=O)S(c1ccc(c(c1)[Cl])OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6461 |
| logD: | 2.6461 |
| logSw: | -3.2921 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.086 |
| InChI Key: | HRGUSHOJLRULIY-UHFFFAOYSA-N |