2-[butyl(methyl)amino]-5-[(5-chloro-2-methoxybenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid
Chemical Structure Depiction of
2-[butyl(methyl)amino]-5-[(5-chloro-2-methoxybenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid
2-[butyl(methyl)amino]-5-[(5-chloro-2-methoxybenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid
Compound characteristics
| Compound ID: | F293-0087 |
| Compound Name: | 2-[butyl(methyl)amino]-5-[(5-chloro-2-methoxybenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid |
| Molecular Weight: | 541.93 |
| Molecular Formula: | C18 H22 Cl N3 O5 S |
| Salt: | CF3COOH |
| Smiles: | CCCCN(C)c1c(cc(cn1)NS(c1cc(ccc1OC)[Cl])(=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6165 |
| logD: | 2.0089 |
| logSw: | -3.8313 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.202 |
| InChI Key: | JNVJODMUWRCHFM-UHFFFAOYSA-N |