3-[(4-ethoxybenzene-1-sulfonyl)amino]-4-[4-(pyridin-2-yl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-[(4-ethoxybenzene-1-sulfonyl)amino]-4-[4-(pyridin-2-yl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1)
3-[(4-ethoxybenzene-1-sulfonyl)amino]-4-[4-(pyridin-2-yl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F292-0316 |
| Compound Name: | 3-[(4-ethoxybenzene-1-sulfonyl)amino]-4-[4-(pyridin-2-yl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 596.58 |
| Molecular Formula: | C24 H26 N4 O5 S |
| Salt: | CF3COOH |
| Smiles: | CCOc1ccc(cc1)S(Nc1cc(ccc1N1CCN(CC1)c1ccccn1)C(O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6272 |
| logD: | 2.8667 |
| logSw: | -4.1987 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.645 |
| InChI Key: | SCKUEEVYLIADSW-UHFFFAOYSA-N |