5-[(3-chloro-2-methylbenzene-1-sulfonyl)amino]-2-(pyrrolidin-1-yl)pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-[(3-chloro-2-methylbenzene-1-sulfonyl)amino]-2-(pyrrolidin-1-yl)pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
5-[(3-chloro-2-methylbenzene-1-sulfonyl)amino]-2-(pyrrolidin-1-yl)pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F293-0460 |
| Compound Name: | 5-[(3-chloro-2-methylbenzene-1-sulfonyl)amino]-2-(pyrrolidin-1-yl)pyridine-3-carboxylic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 509.89 |
| Molecular Formula: | C17 H18 Cl N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | Cc1c(cccc1[Cl])S(Nc1cc(C(O)=O)c(nc1)N1CCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8604 |
| logD: | 2.2529 |
| logSw: | -3.8918 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.185 |
| InChI Key: | OWWPOBMCZCXJAY-UHFFFAOYSA-N |