5-[(benzenesulfonyl)amino]-2-[benzyl(butyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-[(benzenesulfonyl)amino]-2-[benzyl(butyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
5-[(benzenesulfonyl)amino]-2-[benzyl(butyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F293-0627 |
| Compound Name: | 5-[(benzenesulfonyl)amino]-2-[benzyl(butyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 553.56 |
| Molecular Formula: | C23 H25 N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | CCCCN(Cc1ccccc1)c1c(cc(cn1)NS(c1ccccc1)(=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9494 |
| logD: | 3.6185 |
| logSw: | -4.2901 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.36 |
| InChI Key: | AHTFUHMPGNROFI-UHFFFAOYSA-N |