![4-[2-[(1-Carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid structure](/static/products/100/100991-45-5.png)
4-[2-[(1-Carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid
TL;DR: 4-[2-[(1-Carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid (CAS 100991-45-5) is a chemical compound with molecular formula C18H24N2O5S and molecular weight 380.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[(1-carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid
Also Known As: 4-((1-carboxy-3-phenylpropyl)alanyl)thiomorpholine-3-carboxylic acid, 4-[2-[(1-carboxy-3-phenyl-propyl)amino]propanoyl]thiomorpholine-3-carboxylic Acid, 3-Thiomorpholinecarboxylic acid, 4-[2-[[1-(ethoxycarbonyl)-3-phenylpropyl]amino]-1-oxopropyl]-2-methyl-, ethyl ester
| Molecular Formula | C18H24N2O5S |
|---|---|
| Molecular Weight | 380.14 g/mol |
| LogP | 1.0791 |
| Topological Polar Surface Area | 106.94 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 380.1406 |
| Heavy Atoms | 26 |
| Complexity | 639.72845 |
Chemical Identifiers
| CAS Number | 100991-45-5 |
|---|---|
| SMILES | CC(C(=O)N1CCSCC1C(=O)O)NC(CCC2=CC=CC=C2)C(=O)O |
Product Overview
4-[2-[(1-Carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid (CAS 100991-45-5), with molecular formula C18H24N2O5S and molecular weight 380.14 g/mol. IUPAC: 4-[2-[(1-carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid.
Chemical Property Profile of 4-[2-[(1-Carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid
Property Insights of 4-[2-[(1-Carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid
The XLogP value of 1.0791 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[2-[(1-Carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid. The TPSA of 106.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[2-[(1-Carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid. Following Lipinski's Rule of Five, 4-[2-[(1-Carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid has 3 hydrogen bond donor(s) and 5 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 4-[2-[(1-Carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid?
The CAS number of 4-[2-[(1-Carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid is 100991-45-5.
What is the molecular formula of 4-[2-[(1-Carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid?
The molecular formula of 4-[2-[(1-Carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid is C18H24N2O5S.
What is the molecular weight of 4-[2-[(1-Carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid?
The molecular weight of 4-[2-[(1-Carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid is 380.14 g/mol.
Where can I buy 4-[2-[(1-Carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid?
You can request a quote for 4-[2-[(1-Carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[2-[(1-Carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[2-[(1-Carboxy-3-phenylpropyl)amino]propanoyl]thiomorpholine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.