Nalpha-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(4-chloro-2-fluorophenyl)phenylalaninamide
Chemical Structure Depiction of
Nalpha-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(4-chloro-2-fluorophenyl)phenylalaninamide
Nalpha-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(4-chloro-2-fluorophenyl)phenylalaninamide
Compound characteristics
| Compound ID: | C481-1445 |
| Compound Name: | Nalpha-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(4-chloro-2-fluorophenyl)phenylalaninamide |
| Molecular Weight: | 490.96 |
| Molecular Formula: | C21 H16 Cl F N4 O3 S2 |
| Smiles: | C(C(C(Nc1ccc(cc1F)[Cl])=O)NS(c1cccc2c1nsn2)(=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7714 |
| logD: | 4.5092 |
| logSw: | -5.0427 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.187 |
| InChI Key: | MDCPBPLILMHVOS-SFHVURJKSA-N |