2-(diethylamino)-5-[(3,4-dimethoxybenzene-1-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-(diethylamino)-5-[(3,4-dimethoxybenzene-1-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
2-(diethylamino)-5-[(3,4-dimethoxybenzene-1-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F294-0722 |
| Compound Name: | 2-(diethylamino)-5-[(3,4-dimethoxybenzene-1-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 522.5 |
| Molecular Formula: | C19 H24 N2 O6 S |
| Salt: | CF3COOH |
| Smiles: | CCN(CC)c1ccc(cc1C(O)=O)NS(c1ccc(c(c1)OC)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9308 |
| logD: | 0.8152 |
| logSw: | -3.5359 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.992 |
| InChI Key: | HJSPWJULKKTYHG-UHFFFAOYSA-N |