TL;DR: 5-[(Ethylsulfonyl)amino]-3-pyridinecarboxylic acid (CAS 1001566-98-8) is a chemical compound with molecular formula C8H10N2O4S and molecular weight 230.03613 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(ethylsulfonylamino)pyridine-3-carboxylic acid
Also Known As: 5-(ethylsulfonylamino)pyridine-3-carboxylic Acid, 5-[(Ethylsulfonyl)amino]-3-pyridinecarboxylic acid, 5-[(Ethanesulfonyl)amino]pyridine-3-carboxylic acid
| Molecular Formula | C8H10N2O4S |
| Molecular Weight | 230.03613 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 230.03613 Da |
| Heavy Atoms | 15 |
| Complexity | 322.0 |
| SMILES | CCS(=O)(=O)NC1=CN=CC(=C1)C(=O)O |
| InChIKey | XXVZVCBZIXXEQT-UHFFFAOYSA-N |
The XLogP value of -0.3 indicates that 5-[(Ethylsulfonyl)amino]-3-pyridinecarboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(Ethylsulfonyl)amino]-3-pyridinecarboxylic acid. Following Lipinski's Rule of Five, 5-[(Ethylsulfonyl)amino]-3-pyridinecarboxylic acid has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-[(Ethylsulfonyl)amino]-3-pyridinecarboxylic acid is 1001566-98-8.
The molecular formula of 5-[(Ethylsulfonyl)amino]-3-pyridinecarboxylic acid is C8H10N2O4S.
The molecular weight of 5-[(Ethylsulfonyl)amino]-3-pyridinecarboxylic acid is 230.03613 g/mol.
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