N-acetyl-alpha, beta-dehydro-3,4-dihydroxyphenylalanine ethyl ester
TL;DR: N-acetyl-alpha, beta-dehydro-3,4-dihydroxyphenylalanine ethyl ester (CAS 133083-16-6) is a chemical compound with molecular formula C13H15NO5 and molecular weight 265.09503 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (Z)-2-acetamido-3-(3,4-dihydroxyphenyl)prop-2-enoate
Also Known As: Nac-delta-dee, N-Acetyl-delta-dopa ethyl ester, YFSPRL-NH2, ethyl (Z)-2-acetamido-3-(3,4-dihydroxyphenyl)prop-2-enoate, N-Acetyl-alpha, beta-dehydro-3,4-dihydroxyphenylalanine ethyl ester
Technical Specifications
| Molecular Formula | C13H15NO5 |
| Molecular Weight | 265.09503 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 95.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 265.09503 Da |
| Heavy Atoms | 19 |
| Complexity | 366.0 |
| SMILES | CCOC(=O)/C(=C/C1=CC(=C(C=C1)O)O)/NC(=O)C |
| InChIKey | MTXVNBTUWDJENO-POHAHGRESA-N |
Chemical Property Profile of N-acetyl-alpha, beta-dehydro-3,4-dihydroxyphenylalanine ethyl ester
Property Insights of N-acetyl-alpha, beta-dehydro-3,4-dihydroxyphenylalanine ethyl ester
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-acetyl-alpha, beta-dehydro-3,4-dihydroxyphenylalanine ethyl ester. The TPSA of 95.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-acetyl-alpha, beta-dehydro-3,4-dihydroxyphenylalanine ethyl ester. Following Lipinski's Rule of Five, N-acetyl-alpha, beta-dehydro-3,4-dihydroxyphenylalanine ethyl ester 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
What is the CAS number of N-acetyl-alpha, beta-dehydro-3,4-dihydroxyphenylalanine ethyl ester?
The CAS number of N-acetyl-alpha, beta-dehydro-3,4-dihydroxyphenylalanine ethyl ester is 133083-16-6.
What is the molecular formula of N-acetyl-alpha, beta-dehydro-3,4-dihydroxyphenylalanine ethyl ester?
The molecular formula of N-acetyl-alpha, beta-dehydro-3,4-dihydroxyphenylalanine ethyl ester is C13H15NO5.
What is the molecular weight of N-acetyl-alpha, beta-dehydro-3,4-dihydroxyphenylalanine ethyl ester?
The molecular weight of N-acetyl-alpha, beta-dehydro-3,4-dihydroxyphenylalanine ethyl ester is 265.09503 g/mol.
Where can I buy N-acetyl-alpha, beta-dehydro-3,4-dihydroxyphenylalanine ethyl ester?
You can request a quote for N-acetyl-alpha, beta-dehydro-3,4-dihydroxyphenylalanine ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-acetyl-alpha, beta-dehydro-3,4-dihydroxyphenylalanine ethyl ester?
Yes, CoreyChem provides custom synthesis services for N-acetyl-alpha, beta-dehydro-3,4-dihydroxyphenylalanine ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.