5-[(4-acetylbenzene-1-sulfonyl)amino]-2-(diethylamino)benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-[(4-acetylbenzene-1-sulfonyl)amino]-2-(diethylamino)benzoic acid--trifluoroacetic acid (1/1)
5-[(4-acetylbenzene-1-sulfonyl)amino]-2-(diethylamino)benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F294-0747 |
| Compound Name: | 5-[(4-acetylbenzene-1-sulfonyl)amino]-2-(diethylamino)benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 504.48 |
| Molecular Formula: | C19 H22 N2 O5 S |
| Salt: | CF3COOH |
| Smiles: | CCN(CC)c1ccc(cc1C(O)=O)NS(c1ccc(cc1)C(C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9629 |
| logD: | 0.8472 |
| logSw: | -3.3861 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.558 |
| InChI Key: | SFUNLHGRWWGNJG-UHFFFAOYSA-N |