5-[(ethanesulfonyl)amino]-2-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl](methyl)amino}pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-[(ethanesulfonyl)amino]-2-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl](methyl)amino}pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
5-[(ethanesulfonyl)amino]-2-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl](methyl)amino}pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F293-1038 |
| Compound Name: | 5-[(ethanesulfonyl)amino]-2-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl](methyl)amino}pyridine-3-carboxylic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 523.53 |
| Molecular Formula: | C18 H27 N5 O4 S |
| Salt: | CF3COOH |
| Smiles: | CCn1c(C)c(CCN(C)c2c(cc(cn2)NS(CC)(=O)=O)C(O)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.9727 |
| logD: | 0.3651 |
| logSw: | -2.4617 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.476 |
| InChI Key: | JKQSOGNXHLTZKK-UHFFFAOYSA-N |