TL;DR: 2-Ethoxy-5-(morpholinosulfonyl)benzenecarboxylic acid (CAS 866156-09-4) is a chemical compound with molecular formula C13H17NO6S and molecular weight 315.07767 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-ethoxy-5-morpholin-4-ylsulfonylbenzoic acid
Also Known As: 2-ethoxy-5-(morpholinosulfonyl)benzenecarboxylic acid, 2-ethoxy-5-(morpholine-4-sulfonyl)benzoic acid, 2-ethoxy-5-morpholin-4-ylsulfonylbenzoic acid, 2-ethoxy-5-morpholinosulfonyl-benzoic acid, 2-ethoxy-5-(morpholine-4-sulfonyl)benzoicacid
| Molecular Formula | C13H17NO6S |
| Molecular Weight | 315.07767 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.07767 Da |
| Heavy Atoms | 21 |
| Complexity | 454.0 |
| SMILES | CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)O |
| InChIKey | UEJCLSLQYRTJEB-UHFFFAOYSA-N |
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethoxy-5-(morpholinosulfonyl)benzenecarboxylic acid. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Ethoxy-5-(morpholinosulfonyl)benzenecarboxylic acid. Following Lipinski's Rule of Five, 2-Ethoxy-5-(morpholinosulfonyl)benzenecarboxylic acid has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Ethoxy-5-(morpholinosulfonyl)benzenecarboxylic acid is 866156-09-4.
The molecular formula of 2-Ethoxy-5-(morpholinosulfonyl)benzenecarboxylic acid is C13H17NO6S.
The molecular weight of 2-Ethoxy-5-(morpholinosulfonyl)benzenecarboxylic acid is 315.07767 g/mol.
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