5-[(3-chloro-2-methylbenzene-1-sulfonyl)amino]-2-(dimethylamino)pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-[(3-chloro-2-methylbenzene-1-sulfonyl)amino]-2-(dimethylamino)pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
5-[(3-chloro-2-methylbenzene-1-sulfonyl)amino]-2-(dimethylamino)pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F293-0820 |
| Compound Name: | 5-[(3-chloro-2-methylbenzene-1-sulfonyl)amino]-2-(dimethylamino)pyridine-3-carboxylic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 483.85 |
| Molecular Formula: | C15 H16 Cl N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | Cc1c(cccc1[Cl])S(Nc1cc(C(O)=O)c(nc1)N(C)C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1046 |
| logD: | 1.497 |
| logSw: | -3.3834 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.171 |
| InChI Key: | LKNHWFKHRSXYOZ-UHFFFAOYSA-N |