3-(2,1,3-benzoxadiazole-4-sulfonyl)-N-(4-bromo-2-fluorophenyl)propanamide
Chemical Structure Depiction of
3-(2,1,3-benzoxadiazole-4-sulfonyl)-N-(4-bromo-2-fluorophenyl)propanamide
3-(2,1,3-benzoxadiazole-4-sulfonyl)-N-(4-bromo-2-fluorophenyl)propanamide
Compound characteristics
| Compound ID: | C105-0444 |
| Compound Name: | 3-(2,1,3-benzoxadiazole-4-sulfonyl)-N-(4-bromo-2-fluorophenyl)propanamide |
| Molecular Weight: | 428.23 |
| Molecular Formula: | C15 H11 Br F N3 O4 S |
| Smiles: | C(CS(c1cccc2c1non2)(=O)=O)C(Nc1ccc(cc1F)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.1656 |
| logD: | 3.0844 |
| logSw: | -3.4942 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.545 |
| InChI Key: | IQRUWXUCYKWVCP-UHFFFAOYSA-N |