L-Proline, 1-((3,4-dichlorophenyl)methyl)-5-oxo-, methyl ester
TL;DR: L-Proline, 1-((3,4-dichlorophenyl)methyl)-5-oxo-, methyl ester (CAS 59749-19-8) is a chemical compound with molecular formula C13H13Cl2NO3 and molecular weight 301.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-1-[(3,4-dichlorophenyl)methyl]-5-oxopyrrolidine-2-carboxylate
Also Known As: L-Proline, 1-((3,4-dichlorophenyl)methyl)-5-oxo-, methyl ester, N-(Dichloro-3',4' benzyl)pyroglutamate de methyle, N-(Dichloro-3',4' benzyl)pyroglutamate de methyle [French], 1-((3,4-Dichlorophenyl)methyl)-5-oxo-L-proline methyl ester, Methyl 1-[(3,4-dichlorophenyl)methyl]-5-oxo-L-prolinate
| Molecular Formula | C13H13Cl2NO3 |
|---|---|
| Molecular Weight | 301.03 g/mol |
| LogP | 2.6574 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.02725 |
| Heavy Atoms | 19 |
| Complexity | 518.60986 |
Chemical Identifiers
| CAS Number | 59749-19-8 |
|---|---|
| SMILES | COC(=O)[C@@H]1CCC(=O)N1CC2=CC(=C(C=C2)Cl)Cl |
Product Overview
L-Proline, 1-((3,4-dichlorophenyl)methyl)-5-oxo-, methyl ester (CAS 59749-19-8), with molecular formula C13H13Cl2NO3 and molecular weight 301.03 g/mol. IUPAC: methyl (2S)-1-[(3,4-dichlorophenyl)methyl]-5-oxopyrrolidine-2-carboxylate.
Chemical Property Profile of L-Proline, 1-((3,4-dichlorophenyl)methyl)-5-oxo-, methyl ester
Property Insights of L-Proline, 1-((3,4-dichlorophenyl)methyl)-5-oxo-, methyl ester
The XLogP value of 2.6574 suggests moderate lipophilicity, balancing water solubility and membrane permeability for L-Proline, 1-((3,4-dichlorophenyl)methyl)-5-oxo-, methyl ester. With a topological polar surface area (TPSA) of 46.61 Ų, L-Proline, 1-((3,4-dichlorophenyl)methyl)-5-oxo-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, L-Proline, 1-((3,4-dichlorophenyl)methyl)-5-oxo-, methyl ester has 0 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-((3,4-dichlorophenyl)methyl)-5-oxo-, methyl ester?
The CAS number of L-Proline, 1-((3,4-dichlorophenyl)methyl)-5-oxo-, methyl ester is 59749-19-8.
What is the molecular formula of L-Proline, 1-((3,4-dichlorophenyl)methyl)-5-oxo-, methyl ester?
The molecular formula of L-Proline, 1-((3,4-dichlorophenyl)methyl)-5-oxo-, methyl ester is C13H13Cl2NO3.
What is the molecular weight of L-Proline, 1-((3,4-dichlorophenyl)methyl)-5-oxo-, methyl ester?
The molecular weight of L-Proline, 1-((3,4-dichlorophenyl)methyl)-5-oxo-, methyl ester is 301.03 g/mol.
Where can I buy L-Proline, 1-((3,4-dichlorophenyl)methyl)-5-oxo-, methyl ester?
You can request a quote for L-Proline, 1-((3,4-dichlorophenyl)methyl)-5-oxo-, methyl ester 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-((3,4-dichlorophenyl)methyl)-5-oxo-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for L-Proline, 1-((3,4-dichlorophenyl)methyl)-5-oxo-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.