4-[1-(2,1,3-benzothiadiazole-4-sulfonyl)prolyl]-1-(2-phenylethyl)piperazine-2,6-dione
Chemical Structure Depiction of
4-[1-(2,1,3-benzothiadiazole-4-sulfonyl)prolyl]-1-(2-phenylethyl)piperazine-2,6-dione
4-[1-(2,1,3-benzothiadiazole-4-sulfonyl)prolyl]-1-(2-phenylethyl)piperazine-2,6-dione
Compound characteristics
| Compound ID: | C548-3331 |
| Compound Name: | 4-[1-(2,1,3-benzothiadiazole-4-sulfonyl)prolyl]-1-(2-phenylethyl)piperazine-2,6-dione |
| Molecular Weight: | 513.59 |
| Molecular Formula: | C23 H23 N5 O5 S2 |
| Smiles: | C1CC(C(N2CC(N(CCc3ccccc3)C(C2)=O)=O)=O)N(C1)S(c1cccc2c1nsn2)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1666 |
| logD: | 1.1666 |
| logSw: | -2.2153 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 99.754 |
| InChI Key: | DPQXWKMXILGELS-SFHVURJKSA-N |