TL;DR: N-butyl-4-iodobenzenesulfonamide (CAS 1413494-37-7) is a chemical compound with molecular formula C10H14INO2S and molecular weight 338.979 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-butyl-4-iodobenzenesulfonamide
Also Known As: N-butyl-4-iodobenzenesulfonamide, butyl[(4-iodophenyl)sulfonyl]amine, AO-548/40950132
| Molecular Formula | C10H14INO2S |
| Molecular Weight | 338.979 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 338.979 Da |
| Heavy Atoms | 15 |
| Complexity | 266.0 |
| SMILES | CCCCNS(=O)(=O)C1=CC=C(C=C1)I |
| InChIKey | SIWLSZORFPCKCK-UHFFFAOYSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-butyl-4-iodobenzenesulfonamide. With a topological polar surface area (TPSA) of 54.6 Ų, N-butyl-4-iodobenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-butyl-4-iodobenzenesulfonamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-butyl-4-iodobenzenesulfonamide is 1413494-37-7.
The molecular formula of N-butyl-4-iodobenzenesulfonamide is C10H14INO2S.
The molecular weight of N-butyl-4-iodobenzenesulfonamide is 338.979 g/mol.
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