1-{4-[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]phenyl}ethan-1-one
Chemical Structure Depiction of
1-{4-[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]phenyl}ethan-1-one
1-{4-[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]phenyl}ethan-1-one
Compound characteristics
| Compound ID: | Y200-2683 |
| Compound Name: | 1-{4-[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]phenyl}ethan-1-one |
| Molecular Weight: | 386.51 |
| Molecular Formula: | C21 H26 N2 O3 S |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)S(c1c(C)cc(C)cc1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9461 |
| logD: | 3.9461 |
| logSw: | -3.9452 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.036 |
| InChI Key: | KMTPWNFOFFKAAG-UHFFFAOYSA-N |