TL;DR: 4-chloro-N-(3-methylpyridin-2-yl)-2-nitrobenzenesulfonamide (CAS 1022528-34-2) is a chemical compound with molecular formula C12H10ClN3O4S and molecular weight 327.00806 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-N-(3-methyl-2-pyridinyl)-2-nitrobenzenesulfonamide
Also Known As: 4-chloro-N-(3-methylpyridin-2-yl)-2-nitrobenzenesulfonamide, ((4-CHLORO-2-NITROPHENYL)SULFONYL)(3-METHYL(2-PYRIDYL))AMINE, 4-chloro-N-(3-methyl-2-pyridyl)-2-nitro-benzenesulfonamide, 4-chloro-N-(3-methylpyridin-2-yl)-2-nitro-benzenesulfonamide, 4-chloro-N-(3-methylpyridin-2-yl)-2-nitrobenzene-1-sulfonamide
| Molecular Formula | C12H10ClN3O4S |
| Molecular Weight | 327.00806 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 113.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.00806 Da |
| Heavy Atoms | 21 |
| Complexity | 476.0 |
| SMILES | CC1=C(N=CC=C1)NS(=O)(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-] |
| InChIKey | CDSYDFJPIRPLOL-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-N-(3-methylpyridin-2-yl)-2-nitrobenzenesulfonamide. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-N-(3-methylpyridin-2-yl)-2-nitrobenzenesulfonamide. Following Lipinski's Rule of Five, 4-chloro-N-(3-methylpyridin-2-yl)-2-nitrobenzenesulfonamide 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-N-(3-methylpyridin-2-yl)-2-nitrobenzenesulfonamide is 1022528-34-2.
The molecular formula of 4-chloro-N-(3-methylpyridin-2-yl)-2-nitrobenzenesulfonamide is C12H10ClN3O4S.
The molecular weight of 4-chloro-N-(3-methylpyridin-2-yl)-2-nitrobenzenesulfonamide is 327.00806 g/mol.
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