1-[4-(methanesulfonyl)piperazin-1-yl]-2-(4-methyl-2-nitrophenoxy)ethan-1-one
Chemical Structure Depiction of
1-[4-(methanesulfonyl)piperazin-1-yl]-2-(4-methyl-2-nitrophenoxy)ethan-1-one
1-[4-(methanesulfonyl)piperazin-1-yl]-2-(4-methyl-2-nitrophenoxy)ethan-1-one
Compound characteristics
| Compound ID: | Y205-8703 |
| Compound Name: | 1-[4-(methanesulfonyl)piperazin-1-yl]-2-(4-methyl-2-nitrophenoxy)ethan-1-one |
| Molecular Weight: | 357.38 |
| Molecular Formula: | C14 H19 N3 O6 S |
| Smiles: | Cc1ccc(c(c1)[N+]([O-])=O)OCC(N1CCN(CC1)S(C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3675 |
| logD: | 0.3675 |
| logSw: | -2.2013 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 88.309 |
| InChI Key: | BZMRLPNXCHHCAG-UHFFFAOYSA-N |