![2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid structure](/static/products/5502/55021-18-6.webp)
2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid
TL;DR: 2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid (CAS 55021-18-6) is a chemical compound with molecular formula C12H15ClN2O3S and molecular weight 302.0492 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(4-chlorophenyl)carbamoylamino]-4-methylsulfanylbutanoic acid
Also Known As: N-[(4-Chlorophenyl)carbamoyl]methionine, 2-[(4-chlorophenyl)carbamoylamino]-4-methylsulfanylbutanoic acid, 2-[(4-chlorophenyl)carbamoylamino]-4-methylsulfanyl-butanoic acid, 2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H15ClN2O3S |
| Molecular Weight | 302.0492 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 302.0492 Da |
| Heavy Atoms | 19 |
| Complexity | 309.0 |
| SMILES | CSCCC(C(=O)O)NC(=O)NC1=CC=C(C=C1)Cl |
| InChIKey | ZXLLYHLDVWBPIX-UHFFFAOYSA-N |
Product Description
Applications: 2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid is used in pharmaceutical synthesis routes and API production, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid (CAS 55021-18-6) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid is a pharmaceutical intermediate identified by CAS number 55021-18-6 and the molecular formula C12H15ClN2O3S and a molecular weight of 302.05 g/mol. It is also known as N-[(4-Chlorophenyl)carbamoyl]methionine and 2-[(4-chlorophenyl)carbamoylamino]-4-methylsulfanylbutanoic acid.
CoreyChem provides it with COA documentation, and custom synthesis from milligram to multi-kilogram scales is available on request. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid
Property Insights of 2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid. Following Lipinski's Rule of Five, 2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid has 3 hydrogen bond donor(s) and 4 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-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid?
The CAS number of 2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid is 55021-18-6.
What is the molecular formula of 2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid?
The molecular formula of 2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid is C12H15ClN2O3S.
What is the molecular weight of 2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid?
The molecular weight of 2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid is 302.0492 g/mol.
What are the applications of 2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid?
2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid is used in pharmaceutical synthesis routes and API production, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem...
Where can I buy 2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid?
You can request a quote for 2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid?
Yes, CoreyChem provides custom synthesis services for 2-{[N-(4-chlorophenyl)carbamoyl]amino}-4-methylthiobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.