TL;DR: 4-chloro-2-nitro-N-(thiophen-2-ylmethyl)benzenesulfonamide (CAS 1024062-20-1) is a chemical compound with molecular formula C11H9ClN2O4S2 and molecular weight 331.96924 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-2-nitro-N-(thiophen-2-ylmethyl)benzenesulfonamide
Also Known As: 4-chloro-2-nitro-N-(thiophen-2-ylmethyl)benzenesulfonamide, ((4-CHLORO-2-NITROPHENYL)SULFONYL)(2-THIENYLMETHYL)AMINE, 4-chloro-2-nitro-N-(2-thienylmethyl)benzenesulfonamide, 4-chloro-2-nitro-N-[(thiophen-2-yl)methyl]benzene-1-sulfonamide
| Molecular Formula | C11H9ClN2O4S2 |
| Molecular Weight | 331.96924 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 331.96924 Da |
| Heavy Atoms | 20 |
| Complexity | 448.0 |
| SMILES | C1=CSC(=C1)CNS(=O)(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-] |
| InChIKey | ZJCHRVRFWPIMTH-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-2-nitro-N-(thiophen-2-ylmethyl)benzenesulfonamide. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-2-nitro-N-(thiophen-2-ylmethyl)benzenesulfonamide. Following Lipinski's Rule of Five, 4-chloro-2-nitro-N-(thiophen-2-ylmethyl)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-(thiophen-2-ylmethyl)benzenesulfonamide is 1024062-20-1.
The molecular formula of 4-chloro-2-nitro-N-(thiophen-2-ylmethyl)benzenesulfonamide is C11H9ClN2O4S2.
The molecular weight of 4-chloro-2-nitro-N-(thiophen-2-ylmethyl)benzenesulfonamide is 331.96924 g/mol.
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