TL;DR: 5-(Aminosulphonyl)-2-methoxybenzoyl chloride (CAS 52542-44-6) is a chemical compound with molecular formula C8H8ClNO4S and molecular weight 248.98625 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methoxy-5-sulfamoylbenzoyl chloride
Also Known As: 2-methoxy-5-sulfamoylbenzoyl chloride, 5-(Aminosulphonyl)-2-methoxybenzoyl chloride, 5- -2-methoxybenzoylchloride, 2-methoxy-5-sulfamylbenzoyl chloride, 2-methoxy-5-sulfamoyl benzoyl chloride
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C8H8ClNO4S |
| Molecular Weight | 248.98625 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 94.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.98625 Da |
| Heavy Atoms | 15 |
| Complexity | 337.0 |
| SMILES | COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)Cl |
| InChIKey | XFZMCFJADJFEBB-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Aminosulphonyl)-2-methoxybenzoyl chloride. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Aminosulphonyl)-2-methoxybenzoyl chloride. Following Lipinski's Rule of Five, 5-(Aminosulphonyl)-2-methoxybenzoyl chloride 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 5-(Aminosulphonyl)-2-methoxybenzoyl chloride is 52542-44-6.
The molecular formula of 5-(Aminosulphonyl)-2-methoxybenzoyl chloride is C8H8ClNO4S.
The molecular weight of 5-(Aminosulphonyl)-2-methoxybenzoyl chloride is 248.98625 g/mol.
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