N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(2,3-dimethylcyclohexyl)valinamide
Chemical Structure Depiction of
N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(2,3-dimethylcyclohexyl)valinamide
N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(2,3-dimethylcyclohexyl)valinamide
Compound characteristics
| Compound ID: | C548-2920 |
| Compound Name: | N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(2,3-dimethylcyclohexyl)valinamide |
| Molecular Weight: | 424.58 |
| Molecular Formula: | C19 H28 N4 O3 S2 |
| Smiles: | CC(C)C(C(NC1CCCC(C)C1C)=O)NS(c1cccc2c1nsn2)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.291 |
| logD: | 3.2795 |
| logSw: | -3.7837 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.315 |
| InChI Key: | DIOCMYDOPNWSTE-UHFFFAOYSA-N |