N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)valinamide
Chemical Structure Depiction of
N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)valinamide
N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)valinamide
Compound characteristics
| Compound ID: | C548-2767 |
| Compound Name: | N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)valinamide |
| Molecular Weight: | 491.61 |
| Molecular Formula: | C20 H21 N5 O4 S3 |
| Smiles: | CCOc1ccc2c(c1)sc(NC(C(C(C)C)NS(c1cccc3c1nsn3)(=O)=O)=O)n2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3597 |
| logD: | 4.2929 |
| logSw: | -4.2313 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.763 |
| InChI Key: | SVLXQEGZXIWOFB-KRWDZBQOSA-N |