2-(5-Tert-butyl-2-methylbenzenesulfonamido)-4-carbamoylbutanoic acid
TL;DR: 2-(5-Tert-butyl-2-methylbenzenesulfonamido)-4-carbamoylbutanoic acid (CAS 1009483-50-4) is a chemical compound with molecular formula C16H24N2O5S and molecular weight 356.1406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-amino-2-[(5-tert-butyl-2-methylphenyl)sulfonylamino]-5-oxopentanoic acid
Also Known As: 2-(5-tert-butyl-2-methylbenzenesulfonamido)-4-carbamoylbutanoic acid, 5-amino-2-{[(5-tert-butyl-2-methylphenyl)sulfonyl]amino}-5-oxopentanoic acid, 5-amino-2-[(5-tert-butyl-2-methylphenyl)sulfonylamino]-5-oxopentanoic acid, 2-(5-tert-butyl-2-methylbenzenesulfonamido)-4-carbamoylbutanoicacid, 4-carbamoyl-2-[(2-methyl-5-tert-butyl-phenyl)sulfonylamino]butanoic Acid
Technical Specifications
| Molecular Formula | C16H24N2O5S |
| Molecular Weight | 356.1406 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 135.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 356.1406 Da |
| Heavy Atoms | 24 |
| Complexity | 562.0 |
| SMILES | CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NC(CCC(=O)N)C(=O)O |
| InChIKey | DNYQIRRIHRZQRW-UHFFFAOYSA-N |
Chemical Property Profile of 2-(5-Tert-butyl-2-methylbenzenesulfonamido)-4-carbamoylbutanoic acid
Property Insights of 2-(5-Tert-butyl-2-methylbenzenesulfonamido)-4-carbamoylbutanoic acid
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(5-Tert-butyl-2-methylbenzenesulfonamido)-4-carbamoylbutanoic acid. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5-Tert-butyl-2-methylbenzenesulfonamido)-4-carbamoylbutanoic acid. Following Lipinski's Rule of Five, 2-(5-Tert-butyl-2-methylbenzenesulfonamido)-4-carbamoylbutanoic acid has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(5-Tert-butyl-2-methylbenzenesulfonamido)-4-carbamoylbutanoic acid?
The CAS number of 2-(5-Tert-butyl-2-methylbenzenesulfonamido)-4-carbamoylbutanoic acid is 1009483-50-4.
What is the molecular formula of 2-(5-Tert-butyl-2-methylbenzenesulfonamido)-4-carbamoylbutanoic acid?
The molecular formula of 2-(5-Tert-butyl-2-methylbenzenesulfonamido)-4-carbamoylbutanoic acid is C16H24N2O5S.
What is the molecular weight of 2-(5-Tert-butyl-2-methylbenzenesulfonamido)-4-carbamoylbutanoic acid?
The molecular weight of 2-(5-Tert-butyl-2-methylbenzenesulfonamido)-4-carbamoylbutanoic acid is 356.1406 g/mol.
Where can I buy 2-(5-Tert-butyl-2-methylbenzenesulfonamido)-4-carbamoylbutanoic acid?
You can request a quote for 2-(5-Tert-butyl-2-methylbenzenesulfonamido)-4-carbamoylbutanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(5-Tert-butyl-2-methylbenzenesulfonamido)-4-carbamoylbutanoic acid?
Yes, CoreyChem provides custom synthesis services for 2-(5-Tert-butyl-2-methylbenzenesulfonamido)-4-carbamoylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.