TL;DR: N-(4-bromophenyl)-2-nitrobenzenesulfonamide (CAS 159048-82-5) is a chemical compound with molecular formula C12H9BrN2O4S and molecular weight 355.94662 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-bromophenyl)-2-nitrobenzenesulfonamide
Also Known As: N-(4-bromophenyl)-2-nitrobenzenesulfonamide, 6-carbamoylimidazo[1,2-b]pyridazine, Benzenesulfonamide, N-(4-bromophenyl)-2-nitro-, J2.743.143G, N-(4-BROMOPHENYL)-2-NITROBENZENE-1-SULFONAMIDE
| Molecular Formula | C12H9BrN2O4S |
| Molecular Weight | 355.94662 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 355.94662 Da |
| Heavy Atoms | 20 |
| Complexity | 437.0 |
| SMILES | C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)Br |
| InChIKey | SOHBTEQKNABZAP-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-bromophenyl)-2-nitrobenzenesulfonamide. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-bromophenyl)-2-nitrobenzenesulfonamide. Following Lipinski's Rule of Five, N-(4-bromophenyl)-2-nitrobenzenesulfonamide 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-bromophenyl)-2-nitrobenzenesulfonamide is 159048-82-5.
The molecular formula of N-(4-bromophenyl)-2-nitrobenzenesulfonamide is C12H9BrN2O4S.
The molecular weight of N-(4-bromophenyl)-2-nitrobenzenesulfonamide is 355.94662 g/mol.
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