4-[(2,1,3-benzothiadiazole-4-sulfonyl)amino]-3-phenylbutanoic acid
Chemical Structure Depiction of
4-[(2,1,3-benzothiadiazole-4-sulfonyl)amino]-3-phenylbutanoic acid
4-[(2,1,3-benzothiadiazole-4-sulfonyl)amino]-3-phenylbutanoic acid
Compound characteristics
| Compound ID: | 8012-0663 |
| Compound Name: | 4-[(2,1,3-benzothiadiazole-4-sulfonyl)amino]-3-phenylbutanoic acid |
| Molecular Weight: | 377.44 |
| Molecular Formula: | C16 H15 N3 O4 S2 |
| Smiles: | C(C(CNS(c1cccc2c1nsn2)(=O)=O)c1ccccc1)C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0985 |
| logD: | -0.6717 |
| logSw: | -2.7117 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.333 |
| InChI Key: | VUMAYFRPKADKME-LBPRGKRZSA-N |