ethyl (2-{[1-(2,1,3-benzothiadiazole-4-sulfonyl)prolyl]amino}-1,3-thiazol-4-yl)acetate
Chemical Structure Depiction of
ethyl (2-{[1-(2,1,3-benzothiadiazole-4-sulfonyl)prolyl]amino}-1,3-thiazol-4-yl)acetate
ethyl (2-{[1-(2,1,3-benzothiadiazole-4-sulfonyl)prolyl]amino}-1,3-thiazol-4-yl)acetate
Compound characteristics
| Compound ID: | C548-3260 |
| Compound Name: | ethyl (2-{[1-(2,1,3-benzothiadiazole-4-sulfonyl)prolyl]amino}-1,3-thiazol-4-yl)acetate |
| Molecular Weight: | 481.57 |
| Molecular Formula: | C18 H19 N5 O5 S3 |
| Smiles: | CCOC(Cc1csc(NC(C2CCCN2S(c2cccc3c2nsn3)(=O)=O)=O)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.531 |
| logD: | 2.4839 |
| logSw: | -2.8016 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 107.531 |
| InChI Key: | SMQWNKXUTUICKX-ZDUSSCGKSA-N |