![2-[(Cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid structure](/static/products/5502/55021-37-9.webp)
2-[(Cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid
TL;DR: 2-[(Cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid (CAS 55021-37-9) is a chemical compound with molecular formula C12H22N2O3S and molecular weight 274.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(cyclohexylcarbamoylamino)-4-methylsulfanylbutanoic acid
Also Known As: 2-[(cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid, 2-(cyclohexylcarbamoylamino)-4-methylsulfanyl-butanoic Acid, 2-(cyclohexylcarbamoylamino)-4-methylsulfanylbutanoic acid
| Molecular Formula | C12H22N2O3S |
|---|---|
| Molecular Weight | 274.14 g/mol |
| LogP | 1.8246 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 274.1351 |
| Heavy Atoms | 18 |
| Complexity | 280.4961 |
Chemical Identifiers
| CAS Number | 55021-37-9 |
|---|---|
| SMILES | CSCCC(C(=O)O)NC(=O)NC1CCCCC1 |
Product Overview
2-[(Cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid (CAS 55021-37-9), with molecular formula C12H22N2O3S and molecular weight 274.14 g/mol. IUPAC: 2-(cyclohexylcarbamoylamino)-4-methylsulfanylbutanoic acid.
Chemical Property Profile of 2-[(Cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid
Property Insights of 2-[(Cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid
The XLogP value of 1.8246 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(Cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(Cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid. Following Lipinski's Rule of Five, 2-[(Cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(Cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid?
The CAS number of 2-[(Cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid is 55021-37-9.
What is the molecular formula of 2-[(Cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid?
The molecular formula of 2-[(Cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid is C12H22N2O3S.
What is the molecular weight of 2-[(Cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid?
The molecular weight of 2-[(Cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid is 274.14 g/mol.
Where can I buy 2-[(Cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid?
You can request a quote for 2-[(Cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(Cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(Cyclohexylamino)carbonylamino]-4-methylthiobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.