1-[4-(ethanesulfonyl)piperazin-1-yl]-2-(3-methylphenoxy)ethan-1-one--oxalic acid (1/1)
Chemical Structure Depiction of
1-[4-(ethanesulfonyl)piperazin-1-yl]-2-(3-methylphenoxy)ethan-1-one--oxalic acid (1/1)
1-[4-(ethanesulfonyl)piperazin-1-yl]-2-(3-methylphenoxy)ethan-1-one--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 4240-0741 |
| Compound Name: | 1-[4-(ethanesulfonyl)piperazin-1-yl]-2-(3-methylphenoxy)ethan-1-one--oxalic acid (1/1) |
| Molecular Weight: | 416.45 |
| Molecular Formula: | C15 H22 N2 O4 S |
| Salt: | HOOCCOOH |
| Smiles: | CCS(N1CCN(CC1)C(COc1cccc(C)c1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0721 |
| logD: | 1.0721 |
| logSw: | -2.281 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.543 |
| InChI Key: | MCSUHPBXGYPROB-UHFFFAOYSA-N |