TL;DR: N-[4-(diethylamino)phenyl]-3-fluorobenzenesulfonamide (CAS 1177727-55-7) is a chemical compound with molecular formula C16H19FN2O2S and molecular weight 322.1151 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[4-(diethylamino)phenyl]-3-fluorobenzenesulfonamide
Also Known As: N-[4-(diethylamino)phenyl]-3-fluorobenzenesulfonamide, AN-652/43339874
| Molecular Formula | C16H19FN2O2S |
| Molecular Weight | 322.1151 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 57.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 322.1151 Da |
| Heavy Atoms | 22 |
| Complexity | 426.0 |
| SMILES | CCN(CC)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)F |
| InChIKey | TXDSRDZDCNRLJD-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that N-[4-(diethylamino)phenyl]-3-fluorobenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.8 Ų, N-[4-(diethylamino)phenyl]-3-fluorobenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[4-(diethylamino)phenyl]-3-fluorobenzenesulfonamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-[4-(diethylamino)phenyl]-3-fluorobenzenesulfonamide is 1177727-55-7.
The molecular formula of N-[4-(diethylamino)phenyl]-3-fluorobenzenesulfonamide is C16H19FN2O2S.
The molecular weight of N-[4-(diethylamino)phenyl]-3-fluorobenzenesulfonamide is 322.1151 g/mol.
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