TL;DR: N-(3-iodo-4-methylphenyl)benzenesulfonamide (CAS 1095940-37-6) is a chemical compound with molecular formula C13H12INO2S and molecular weight 372.96335 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3-iodo-4-methylphenyl)benzenesulfonamide
Also Known As: N-(3-iodo-4-methylphenyl)benzenesulfonamide, benzenesulfonamide, n- (3- iodo- 4- methylphenyl) -
| Molecular Formula | C13H12INO2S |
| Molecular Weight | 372.96335 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 372.96335 Da |
| Heavy Atoms | 18 |
| Complexity | 360.0 |
| SMILES | CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=CC=C2)I |
| InChIKey | OWWAQLGNGBTLNS-UHFFFAOYSA-N |
The XLogP value of 3.5 indicates that N-(3-iodo-4-methylphenyl)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.6 Ų, N-(3-iodo-4-methylphenyl)benzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-iodo-4-methylphenyl)benzenesulfonamide 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-(3-iodo-4-methylphenyl)benzenesulfonamide is 1095940-37-6.
The molecular formula of N-(3-iodo-4-methylphenyl)benzenesulfonamide is C13H12INO2S.
The molecular weight of N-(3-iodo-4-methylphenyl)benzenesulfonamide is 372.96335 g/mol.
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