1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate
TL;DR: 1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate (CAS 207304-86-7) is a chemical compound with molecular formula C14H18N2O4 and molecular weight 278.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-O-benzyl 2-O-methyl 4-aminopyrrolidine-1,2-dicarboxylate
Also Known As: 1-benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate, 1-benzyl 2-methyl (2S,4R)-4-aminopyrrolidine-1,2-dicarboxylate, Benzyl Methyl 4-aminopyrrolidine-1,2-dicarboxylate, Methyl (2R,4S)-4-Amino-1-Cbz-pyrrolidine-2-carboxylate, 1-benzyl2-methyl4-aminopyrrolidine-1,2-dicarboxylate
| Molecular Formula | C14H18N2O4 |
|---|---|
| Molecular Weight | 278.13 g/mol |
| LogP | 0.8978 |
| Topological Polar Surface Area | 81.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.12665 |
| Heavy Atoms | 20 |
| Complexity | 477.32205 |
Chemical Identifiers
| CAS Number | 207304-86-7 |
|---|---|
| SMILES | COC(=O)C1CC(CN1C(=O)OCC2=CC=CC=C2)N |
Product Overview
1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate (CAS 207304-86-7), with molecular formula C14H18N2O4 and molecular weight 278.13 g/mol. IUPAC: 1-O-benzyl 2-O-methyl 4-aminopyrrolidine-1,2-dicarboxylate.
Chemical Property Profile of 1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate
Property Insights of 1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate
The XLogP value of 0.8978 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate. The TPSA of 81.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate. Following Lipinski's Rule of Five, 1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate 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 1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate?
The CAS number of 1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate is 207304-86-7.
What is the molecular formula of 1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate?
The molecular formula of 1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate is C14H18N2O4.
What is the molecular weight of 1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate?
The molecular weight of 1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate is 278.13 g/mol.
Where can I buy 1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate?
You can request a quote for 1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.