N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]valinamide
Chemical Structure Depiction of
N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]valinamide
N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]valinamide
Compound characteristics
| Compound ID: | C548-2802 |
| Compound Name: | N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]valinamide |
| Molecular Weight: | 478.59 |
| Molecular Formula: | C21 H26 N4 O5 S2 |
| Smiles: | CC(C)C(C(NCCc1ccc(c(c1)OC)OC)=O)NS(c1cccc2c1nsn2)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2183 |
| logD: | 2.2067 |
| logSw: | -2.9217 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.302 |
| InChI Key: | ORRSPXKRSOSNOW-IBGZPJMESA-N |