![methyl N-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate structure](/static/products/117/1173687-80-3.png)
methyl N-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate
TL;DR: methyl N-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate (CAS 1173687-80-3) is a chemical compound with molecular formula C17H24FN3O3S and molecular weight 369.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-2-[[4-(4-fluorophenyl)piperazine-1-carbonyl]amino]-4-methylsulfanylbutanoate
Also Known As: methyl N-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate, (S)-methyl 2-(4-(4-fluorophenyl)piperazine-1-carboxamido)-4-(methylthio)butanoate, methyl (2S)-2-[[4-(4-fluorophenyl)piperazine-1-carbonyl]amino]-4-methylsulfanylbutanoate
| Molecular Formula | C17H24FN3O3S |
|---|---|
| Molecular Weight | 369.15 g/mol |
| LogP | 1.952 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 369.15225 |
| Heavy Atoms | 25 |
| Complexity | 577.00574 |
Chemical Identifiers
| CAS Number | 1173687-80-3 |
|---|---|
| SMILES | COC(=O)[C@H](CCSC)NC(=O)N1CCN(CC1)C2=CC=C(C=C2)F |
Product Overview
methyl N-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate (CAS 1173687-80-3), with molecular formula C17H24FN3O3S and molecular weight 369.15 g/mol. IUPAC: methyl (2S)-2-[[4-(4-fluorophenyl)piperazine-1-carbonyl]amino]-4-methylsulfanylbutanoate.
Chemical Property Profile of methyl N-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate
Property Insights of methyl N-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate
The XLogP value of 1.952 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate. Following Lipinski's Rule of Five, methyl N-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate has 1 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 methyl N-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate?
The CAS number of methyl N-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate is 1173687-80-3.
What is the molecular formula of methyl N-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate?
The molecular formula of methyl N-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate is C17H24FN3O3S.
What is the molecular weight of methyl N-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate?
The molecular weight of methyl N-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate is 369.15 g/mol.
Where can I buy methyl N-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate?
You can request a quote for methyl N-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate 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-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-methioninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.