5-[(4-acetylbenzene-1-sulfonyl)amino]-2-[benzyl(ethyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-[(4-acetylbenzene-1-sulfonyl)amino]-2-[benzyl(ethyl)amino]benzoic acid--trifluoroacetic acid (1/1)
5-[(4-acetylbenzene-1-sulfonyl)amino]-2-[benzyl(ethyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F294-0038 |
| Compound Name: | 5-[(4-acetylbenzene-1-sulfonyl)amino]-2-[benzyl(ethyl)amino]benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 566.55 |
| Molecular Formula: | C24 H24 N2 O5 S |
| Salt: | CF3COOH |
| Smiles: | CCN(Cc1ccccc1)c1ccc(cc1C(O)=O)NS(c1ccc(cc1)C(C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9971 |
| logD: | 2.165 |
| logSw: | -4.069 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.562 |
| InChI Key: | JNOYWSPRSRWQFA-UHFFFAOYSA-N |