2-(azocan-1-yl)-5-[(2,4-dimethylbenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid
Chemical Structure Depiction of
2-(azocan-1-yl)-5-[(2,4-dimethylbenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid
2-(azocan-1-yl)-5-[(2,4-dimethylbenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid
Compound characteristics
| Compound ID: | F293-0672 |
| Compound Name: | 2-(azocan-1-yl)-5-[(2,4-dimethylbenzene-1-sulfonyl)amino]pyridine-3-carboxylic acid |
| Molecular Weight: | 531.55 |
| Molecular Formula: | C21 H27 N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(c(C)c1)S(Nc1cc(C(O)=O)c(nc1)N1CCCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2947 |
| logD: | 3.6871 |
| logSw: | -4.7674 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.15 |
| InChI Key: | ZWBJOBLUZOYNQI-UHFFFAOYSA-N |