4-[3-(2,1,3-benzoxadiazole-4-sulfonyl)propanoyl]-1-(2-phenylethyl)piperazine-2,6-dione
Chemical Structure Depiction of
4-[3-(2,1,3-benzoxadiazole-4-sulfonyl)propanoyl]-1-(2-phenylethyl)piperazine-2,6-dione
4-[3-(2,1,3-benzoxadiazole-4-sulfonyl)propanoyl]-1-(2-phenylethyl)piperazine-2,6-dione
Compound characteristics
| Compound ID: | C105-0601 |
| Compound Name: | 4-[3-(2,1,3-benzoxadiazole-4-sulfonyl)propanoyl]-1-(2-phenylethyl)piperazine-2,6-dione |
| Molecular Weight: | 456.48 |
| Molecular Formula: | C21 H20 N4 O6 S |
| Smiles: | C(CS(c1cccc2c1non2)(=O)=O)C(N1CC(N(CCc2ccccc2)C(C1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0002 |
| logD: | 1.0002 |
| logSw: | -2.0537 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 110.853 |
| InChI Key: | ZIZXJEFWQPXWEJ-UHFFFAOYSA-N |