5-[(4-methoxybenzene-1-sulfonyl)amino]-2-{methyl[(3-methyl-1-propyl-1H-pyrazol-5-yl)methyl]amino}pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-[(4-methoxybenzene-1-sulfonyl)amino]-2-{methyl[(3-methyl-1-propyl-1H-pyrazol-5-yl)methyl]amino}pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
5-[(4-methoxybenzene-1-sulfonyl)amino]-2-{methyl[(3-methyl-1-propyl-1H-pyrazol-5-yl)methyl]amino}pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F293-1062 |
| Compound Name: | 5-[(4-methoxybenzene-1-sulfonyl)amino]-2-{methyl[(3-methyl-1-propyl-1H-pyrazol-5-yl)methyl]amino}pyridine-3-carboxylic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 587.57 |
| Molecular Formula: | C22 H27 N5 O5 S |
| Salt: | CF3COOH |
| Smiles: | CCCn1c(CN(C)c2c(cc(cn2)NS(c2ccc(cc2)OC)(=O)=O)C(O)=O)cc(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.9327 |
| logD: | 1.6019 |
| logSw: | -3.3936 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.361 |
| InChI Key: | GUGMJEINSYDKSS-UHFFFAOYSA-N |