5-[(4-acetylbenzene-1-sulfonyl)amino]-2-[benzyl(ethyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-[(4-acetylbenzene-1-sulfonyl)amino]-2-[benzyl(ethyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
5-[(4-acetylbenzene-1-sulfonyl)amino]-2-[benzyl(ethyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F293-0038 |
| Compound Name: | 5-[(4-acetylbenzene-1-sulfonyl)amino]-2-[benzyl(ethyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 567.54 |
| Molecular Formula: | C23 H23 N3 O5 S |
| Salt: | CF3COOH |
| Smiles: | CCN(Cc1ccccc1)c1c(cc(cn1)NS(c1ccc(cc1)C(C)=O)(=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.66 |
| logD: | 2.3292 |
| logSw: | -3.7437 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.933 |
| InChI Key: | SBHRDOKMVDIOGP-UHFFFAOYSA-N |