1-[1-(2,5-dimethylbenzene-1-sulfonyl)piperidin-4-yl]-4-[(4-methylphenyl)methyl]piperazine-2,3-dione
Chemical Structure Depiction of
1-[1-(2,5-dimethylbenzene-1-sulfonyl)piperidin-4-yl]-4-[(4-methylphenyl)methyl]piperazine-2,3-dione
1-[1-(2,5-dimethylbenzene-1-sulfonyl)piperidin-4-yl]-4-[(4-methylphenyl)methyl]piperazine-2,3-dione
Compound characteristics
| Compound ID: | F117-0131 |
| Compound Name: | 1-[1-(2,5-dimethylbenzene-1-sulfonyl)piperidin-4-yl]-4-[(4-methylphenyl)methyl]piperazine-2,3-dione |
| Molecular Weight: | 469.6 |
| Molecular Formula: | C25 H31 N3 O4 S |
| Smiles: | Cc1ccc(CN2CCN(C3CCN(CC3)S(c3cc(C)ccc3C)(=O)=O)C(C2=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6911 |
| logD: | 3.6911 |
| logSw: | -3.6748 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.189 |
| InChI Key: | YQDGRWMCDQOEGY-UHFFFAOYSA-N |