l-proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt
TL;DR: l-proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt (CAS 59749-27-8) is a chemical compound with molecular formula C12H15FN2O3 and molecular weight 254.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azanium (2S)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-2-carboxylate
Also Known As: N-(p-Fluorobenzyl)pyroglutamate d'ammonium, N-(p-Fluorobenzyl)pyroglutamate d'ammonium [French], L-Proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt, 1-((4-Fluorophenyl)methyl)-5-oxo-L-proline ammonium salt, Ammonium (2S)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-2-carboxylate
| Molecular Formula | C12H15FN2O3 |
|---|---|
| Molecular Weight | 254.11 g/mol |
| LogP | 0.4428 |
| Topological Polar Surface Area | 96.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 254.10667 |
| Heavy Atoms | 18 |
| Complexity | 447.1407 |
Chemical Identifiers
| CAS Number | 59749-27-8 |
|---|---|
| SMILES | C1CC(=O)N([C@@H]1C(=O)[O-])CC2=CC=C(C=C2)F.[NH4+] |
Product Overview
l-proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt (CAS 59749-27-8), with molecular formula C12H15FN2O3 and molecular weight 254.11 g/mol. IUPAC: azanium (2S)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-2-carboxylate.
Chemical Property Profile of l-proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt
Property Insights of l-proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt
The XLogP value of 0.4428 suggests moderate lipophilicity, balancing water solubility and membrane permeability for l-proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt. The TPSA of 96.94 Ų falls within the moderate polarity range, balancing permeability and solubility for l-proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt. Following Lipinski's Rule of Five, l-proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt has 1 hydrogen bond donor(s) and 3 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 l-proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt?
The CAS number of l-proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt is 59749-27-8.
What is the molecular formula of l-proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt?
The molecular formula of l-proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt is C12H15FN2O3.
What is the molecular weight of l-proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt?
The molecular weight of l-proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt is 254.11 g/mol.
Where can I buy l-proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt?
You can request a quote for l-proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for l-proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt?
Yes, KEHONG BIO provides custom synthesis services for l-proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.