N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[2-(cyclohex-1-en-1-yl)ethyl]valinamide
Chemical Structure Depiction of
N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[2-(cyclohex-1-en-1-yl)ethyl]valinamide
N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[2-(cyclohex-1-en-1-yl)ethyl]valinamide
Compound characteristics
| Compound ID: | C548-2760 |
| Compound Name: | N~2~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[2-(cyclohex-1-en-1-yl)ethyl]valinamide |
| Molecular Weight: | 422.57 |
| Molecular Formula: | C19 H26 N4 O3 S2 |
| Smiles: | CC(C)C(C(NCCC1CCCCC=1)=O)NS(c1cccc2c1nsn2)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0717 |
| logD: | 3.0601 |
| logSw: | -3.4151 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.233 |
| InChI Key: | TVVFLRKTQIZXAA-KRWDZBQOSA-N |