2-[benzyl(methyl)amino]-5-[(3,4-dimethoxybenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-[benzyl(methyl)amino]-5-[(3,4-dimethoxybenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
2-[benzyl(methyl)amino]-5-[(3,4-dimethoxybenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F293-0198 |
| Compound Name: | 2-[benzyl(methyl)amino]-5-[(3,4-dimethoxybenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 571.53 |
| Molecular Formula: | C22 H23 N3 O6 S |
| Salt: | CF3COOH |
| Smiles: | CN(Cc1ccccc1)c1c(cc(cn1)NS(c1ccc(c(c1)OC)OC)(=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4325 |
| logD: | 2.1017 |
| logSw: | -3.7174 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.582 |
| InChI Key: | URYPDHPEXJDVEX-UHFFFAOYSA-N |