5-[(4-ethoxybenzene-1-sulfonyl)amino]-2-(4-methylpiperidin-1-yl)benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-[(4-ethoxybenzene-1-sulfonyl)amino]-2-(4-methylpiperidin-1-yl)benzoic acid--trifluoroacetic acid (1/1)
5-[(4-ethoxybenzene-1-sulfonyl)amino]-2-(4-methylpiperidin-1-yl)benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F294-0169 |
| Compound Name: | 5-[(4-ethoxybenzene-1-sulfonyl)amino]-2-(4-methylpiperidin-1-yl)benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 532.53 |
| Molecular Formula: | C21 H26 N2 O5 S |
| Salt: | CF3COOH |
| Smiles: | CCOc1ccc(cc1)S(Nc1ccc(c(c1)C(O)=O)N1CCC(C)CC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4652 |
| logD: | 2.3495 |
| logSw: | -4.1693 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.571 |
| InChI Key: | JNXXHNUTZDRMPT-UHFFFAOYSA-N |