TL;DR: 4-chloro-2-nitro-N-(4-phenoxyphenyl)benzenesulfonamide (CAS 1023810-86-7) is a chemical compound with molecular formula C18H13ClN2O5S and molecular weight 404.02338 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-2-nitro-N-(4-phenoxyphenyl)benzenesulfonamide
Also Known As: 4-chloro-2-nitro-N-(4-phenoxyphenyl)benzenesulfonamide, ((4-CHLORO-2-NITROPHENYL)SULFONYL)(4-PHENOXYPHENYL)AMINE, 4-chloro-2-nitro-N-(4-phenoxyphenyl)benzene-1-sulfonamide
| Molecular Formula | C18H13ClN2O5S |
| Molecular Weight | 404.02338 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 404.02338 Da |
| Heavy Atoms | 27 |
| Complexity | 592.0 |
| SMILES | C1=CC=C(C=C1)OC2=CC=C(C=C2)NS(=O)(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-] |
| InChIKey | KDSHNMGGRTZVCB-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that 4-chloro-2-nitro-N-(4-phenoxyphenyl)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-2-nitro-N-(4-phenoxyphenyl)benzenesulfonamide. Following Lipinski's Rule of Five, 4-chloro-2-nitro-N-(4-phenoxyphenyl)benzenesulfonamide has 1 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 4-chloro-2-nitro-N-(4-phenoxyphenyl)benzenesulfonamide is 1023810-86-7.
The molecular formula of 4-chloro-2-nitro-N-(4-phenoxyphenyl)benzenesulfonamide is C18H13ClN2O5S.
The molecular weight of 4-chloro-2-nitro-N-(4-phenoxyphenyl)benzenesulfonamide is 404.02338 g/mol.
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