N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(6-chloro-1,3-benzothiazol-2-yl)valinamide
Chemical Structure Depiction of
N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(6-chloro-1,3-benzothiazol-2-yl)valinamide
N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(6-chloro-1,3-benzothiazol-2-yl)valinamide
Compound characteristics
| Compound ID: | C548-2844 |
| Compound Name: | N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(6-chloro-1,3-benzothiazol-2-yl)valinamide |
| Molecular Weight: | 482 |
| Molecular Formula: | C18 H16 Cl N5 O3 S3 |
| Smiles: | CC(C)C(C(Nc1nc2ccc(cc2s1)[Cl])=O)NS(c1cccc2c1nsn2)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5371 |
| logD: | 4.4703 |
| logSw: | -4.5938 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.639 |
| InChI Key: | ZYQOGMCVPTWEDR-HNNXBMFYSA-N |