![4-Methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid structure](/static/products/7626/76264-05-6.webp)
4-Methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid
TL;DR: 4-Methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid (CAS 76264-05-6) is a chemical compound with molecular formula C16H22N2O5S and molecular weight 354.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid
Also Known As: Z-ALA-MET-OH, N-Cbz-DL-alanyl-DL-methionine, N-[(Benzyloxy)carbonyl]alanylmethionine, 4-methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid, ((Benzyloxy)carbonyl)-L-alanyl-L-methionine
| Molecular Formula | C16H22N2O5S |
|---|---|
| Molecular Weight | 354.12 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 354.12494 |
| Heavy Atoms | 24 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 76264-05-6 |
|---|---|
| SMILES | CC(C(=O)NC(CCSC)C(=O)O)NC(=O)OCC1=CC=CC=C1 |
| InChIKey | YYUCTNWOJJIRAB-UHFFFAOYSA-N |
Product Overview
4-Methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid (CAS 76264-05-6), with molecular formula C16H22N2O5S and molecular weight 354.12 g/mol. IUPAC: 4-methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid.
Chemical Property Profile of 4-Methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid
Property Insights of 4-Methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid. Following Lipinski's Rule of Five, 4-Methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic 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
Frequently Asked Questions
What is the CAS number of 4-Methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid?
The CAS number of 4-Methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid is 76264-05-6.
What is the molecular formula of 4-Methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid?
The molecular formula of 4-Methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid is C16H22N2O5S.
What is the molecular weight of 4-Methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid?
The molecular weight of 4-Methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid is 354.12 g/mol.
Where can I buy 4-Methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid?
You can request a quote for 4-Methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Methylsulfanyl-2-[2-(phenylmethoxycarbonylamino)propanoylamino]butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.