3-[(2,1,3-benzothiadiazole-4-sulfonyl)amino]-3-(4-chlorophenyl)propanoic acid
Chemical Structure Depiction of
3-[(2,1,3-benzothiadiazole-4-sulfonyl)amino]-3-(4-chlorophenyl)propanoic acid
3-[(2,1,3-benzothiadiazole-4-sulfonyl)amino]-3-(4-chlorophenyl)propanoic acid
Compound characteristics
| Compound ID: | 8012-3615 |
| Compound Name: | 3-[(2,1,3-benzothiadiazole-4-sulfonyl)amino]-3-(4-chlorophenyl)propanoic acid |
| Molecular Weight: | 397.86 |
| Molecular Formula: | C15 H12 Cl N3 O4 S2 |
| Smiles: | C(C(c1ccc(cc1)[Cl])NS(c1cccc2c1nsn2)(=O)=O)C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8267 |
| logD: | 0.0258 |
| logSw: | -3.7449 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.177 |
| InChI Key: | SGQLMLKFYNQNOY-LBPRGKRZSA-N |