TL;DR: Methyl 2-{[(4-chlorophenyl)sulfonyl]amino}acetate (CAS 106111-15-3) is a chemical compound with molecular formula C9H10ClNO4S and molecular weight 263.0019 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-[(4-chlorophenyl)sulfonylamino]acetate
Also Known As: methyl 2-{[(4-chlorophenyl)sulfonyl]amino}acetate, methyl 2-[(4-chlorophenyl)sulfonylamino]acetate, BAS 00341299, methyl 2-(4-chlorophenylsulfonamido)acetate, methyl N-[(4-chlorophenyl)sulfonyl]glycinate
| Molecular Formula | C9H10ClNO4S |
| Molecular Weight | 263.0019 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 80.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 263.0019 Da |
| Heavy Atoms | 16 |
| Complexity | 330.0 |
| SMILES | COC(=O)CNS(=O)(=O)C1=CC=C(C=C1)Cl |
| InChIKey | SYOQNYMPQNXLCA-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-{[(4-chlorophenyl)sulfonyl]amino}acetate. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-{[(4-chlorophenyl)sulfonyl]amino}acetate. Following Lipinski's Rule of Five, Methyl 2-{[(4-chlorophenyl)sulfonyl]amino}acetate 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 Methyl 2-{[(4-chlorophenyl)sulfonyl]amino}acetate is 106111-15-3.
The molecular formula of Methyl 2-{[(4-chlorophenyl)sulfonyl]amino}acetate is C9H10ClNO4S.
The molecular weight of Methyl 2-{[(4-chlorophenyl)sulfonyl]amino}acetate is 263.0019 g/mol.
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