2-(dimethylamino)-5-[(2,4-dimethylbenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-(dimethylamino)-5-[(2,4-dimethylbenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
2-(dimethylamino)-5-[(2,4-dimethylbenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F293-0802 |
| Compound Name: | 2-(dimethylamino)-5-[(2,4-dimethylbenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 463.43 |
| Molecular Formula: | C16 H19 N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(c(C)c1)S(Nc1cc(C(O)=O)c(nc1)N(C)C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1304 |
| logD: | 1.5228 |
| logSw: | -3.1911 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.171 |
| InChI Key: | KVHLWMCPWDLOTN-UHFFFAOYSA-N |