6-{[2-(dimethylamino)ethyl](ethyl)amino}-5-[(3-fluorobenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
6-{[2-(dimethylamino)ethyl](ethyl)amino}-5-[(3-fluorobenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
6-{[2-(dimethylamino)ethyl](ethyl)amino}-5-[(3-fluorobenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F296-0506 |
| Compound Name: | 6-{[2-(dimethylamino)ethyl](ethyl)amino}-5-[(3-fluorobenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 524.49 |
| Molecular Formula: | C18 H23 F N4 O4 S |
| Salt: | CF3COOH |
| Smiles: | CCN(CCN(C)C)c1c(cc(cn1)C(O)=O)NS(c1cccc(c1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5417 |
| logD: | 2.5417 |
| logSw: | -2.6885 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.524 |
| InChI Key: | XIMTXYVHMPVPFF-UHFFFAOYSA-N |