![methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate structure](/static/products/958/958983-79-4.png)
methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate
TL;DR: methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate (CAS 958983-79-4) is a chemical compound with molecular formula C21H25N3O3 and molecular weight 367.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-3-phenyl-2-[(4-phenylpiperazine-1-carbonyl)amino]propanoate
Also Known As: methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate, (S)-methyl 3-phenyl-2-(4-phenylpiperazine-1-carboxamido)propanoate, methyl (2S)-3-phenyl-2-[(4-phenylpiperazine-1-carbonyl)amino]propanoate, (S)-3-Phenyl-2-[(4-phenyl-piperazine-1-carbonyl)-amino]-propionic acid methyl ester
| Molecular Formula | C21H25N3O3 |
|---|---|
| Molecular Weight | 367.19 g/mol |
| LogP | 2.3025 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 367.1896 |
| Heavy Atoms | 27 |
| Complexity | 743.78186 |
Chemical Identifiers
| CAS Number | 958983-79-4 |
|---|---|
| SMILES | COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)N2CCN(CC2)C3=CC=CC=C3 |
Product Overview
methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate (CAS 958983-79-4), with molecular formula C21H25N3O3 and molecular weight 367.19 g/mol. IUPAC: methyl (2S)-3-phenyl-2-[(4-phenylpiperazine-1-carbonyl)amino]propanoate.
Chemical Property Profile of methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate
Property Insights of methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate
The XLogP value of 2.3025 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate. Following Lipinski's Rule of Five, methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate has 1 hydrogen bond donor(s) and 4 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 methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate?
The CAS number of methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate is 958983-79-4.
What is the molecular formula of methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate?
The molecular formula of methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate is C21H25N3O3.
What is the molecular weight of methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate?
The molecular weight of methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate is 367.19 g/mol.
Where can I buy methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate?
You can request a quote for methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-[(4-phenylpiperazin-1-yl)carbonyl]-L-phenylalaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.