TL;DR: 8-(Benzenesulfonamido)-7-(3-pyridinyl)octanoic acid (CAS 134162-37-1) is a chemical compound with molecular formula C19H24N2O4S and molecular weight 376.1457 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-(benzenesulfonamido)-7-pyridin-3-yloctanoic acid
Also Known As: 8-Bspoa, 8- -7- octanoicacid, 8-(Benzenesulfonamido)-7-(3-pyridinyl)octanoic acid, 8-(benzenesulfonamido)-7-pyridin-3-yloctanoic acid, 3-Pyridineheptanoicacid, z-[[(phenylsulfonyl)amino]methyl]-
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C19H24N2O4S |
| Molecular Weight | 376.1457 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 376.1457 Da |
| Heavy Atoms | 26 |
| Complexity | 512.0 |
| SMILES | C1=CC=C(C=C1)S(=O)(=O)NCC(CCCCCC(=O)O)C2=CN=CC=C2 |
| InChIKey | IHYHXWDRZIXCRQ-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-(Benzenesulfonamido)-7-(3-pyridinyl)octanoic acid. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-(Benzenesulfonamido)-7-(3-pyridinyl)octanoic acid. Following Lipinski's Rule of Five, 8-(Benzenesulfonamido)-7-(3-pyridinyl)octanoic 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 8-(Benzenesulfonamido)-7-(3-pyridinyl)octanoic acid is 134162-37-1.
The molecular formula of 8-(Benzenesulfonamido)-7-(3-pyridinyl)octanoic acid is C19H24N2O4S.
The molecular weight of 8-(Benzenesulfonamido)-7-(3-pyridinyl)octanoic acid is 376.1457 g/mol.
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