2-(dimethylamino)-5-[(4-ethoxybenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-(dimethylamino)-5-[(4-ethoxybenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
2-(dimethylamino)-5-[(4-ethoxybenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F293-0812 |
| Compound Name: | 2-(dimethylamino)-5-[(4-ethoxybenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 479.43 |
| Molecular Formula: | C16 H19 N3 O5 S |
| Salt: | CF3COOH |
| Smiles: | CCOc1ccc(cc1)S(Nc1cc(C(O)=O)c(nc1)N(C)C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.62 |
| logD: | 1.0124 |
| logSw: | -2.9961 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.295 |
| InChI Key: | QVBPTQUQVMWRTK-UHFFFAOYSA-N |