Methyl 4-(N-methyl4-methylbenzenesulfonamido)benzoate
TL;DR: Methyl 4-(N-methyl4-methylbenzenesulfonamido)benzoate (CAS 158038-69-8) is a chemical compound with molecular formula C16H17NO4S and molecular weight 319.08783 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-[methyl-(4-methylphenyl)sulfonylamino]benzoate
Also Known As: 4-(Methyltosylamino)benzoic acid methyl ester, J1.316.383I, 4-(N-Methyltosylamino)benzoic acid methyl ester, METHYL 4-(N-METHYL4-METHYLBENZENESULFONAMIDO)BENZOATE, Methyl 4-[methyl-(4-methylphenyl)sulfonyl-amino]benzoate
Technical Specifications
| Molecular Formula | C16H17NO4S |
| Molecular Weight | 319.08783 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.08783 Da |
| Heavy Atoms | 22 |
| Complexity | 469.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)OC |
| InChIKey | AZTPEGWYCCQLBW-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 4-(N-methyl4-methylbenzenesulfonamido)benzoate
Property Insights of Methyl 4-(N-methyl4-methylbenzenesulfonamido)benzoate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-(N-methyl4-methylbenzenesulfonamido)benzoate. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-(N-methyl4-methylbenzenesulfonamido)benzoate. Following Lipinski's Rule of Five, Methyl 4-(N-methyl4-methylbenzenesulfonamido)benzoate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methyl 4-(N-methyl4-methylbenzenesulfonamido)benzoate?
The CAS number of Methyl 4-(N-methyl4-methylbenzenesulfonamido)benzoate is 158038-69-8.
What is the molecular formula of Methyl 4-(N-methyl4-methylbenzenesulfonamido)benzoate?
The molecular formula of Methyl 4-(N-methyl4-methylbenzenesulfonamido)benzoate is C16H17NO4S.
What is the molecular weight of Methyl 4-(N-methyl4-methylbenzenesulfonamido)benzoate?
The molecular weight of Methyl 4-(N-methyl4-methylbenzenesulfonamido)benzoate is 319.08783 g/mol.
Where can I buy Methyl 4-(N-methyl4-methylbenzenesulfonamido)benzoate?
You can request a quote for Methyl 4-(N-methyl4-methylbenzenesulfonamido)benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 4-(N-methyl4-methylbenzenesulfonamido)benzoate?
Yes, CoreyChem provides custom synthesis services for Methyl 4-(N-methyl4-methylbenzenesulfonamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.