(4R)-1-N-Boc-4-Benzyl-D-proline
TL;DR: (4R)-1-N-Boc-4-Benzyl-D-proline (CAS 158459-13-3) is a chemical compound with molecular formula C17H22NO4- and molecular weight 304.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,4R)-4-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylate
Also Known As: (4R)-1-N-Boc-4-Benzyl-D-proline, (2R,4R)-4-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylate, 1,2-Pyrrolidinedicarboxylic acid, 4-(phenylmethyl)-, 1-(1,1-dimethylethyl) ester, (2R-cis)- (9CI)
| Molecular Formula | C17H22NO4- |
|---|---|
| Molecular Weight | 304.15 g/mol |
| LogP | 1.6046 |
| Topological Polar Surface Area | 69.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 304.15488 |
| Heavy Atoms | 22 |
| Complexity | 535.33997 |
Chemical Identifiers
| CAS Number | 158459-13-3 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1C[C@@H](C[C@@H]1C(=O)[O-])CC2=CC=CC=C2 |
Product Overview
(4R)-1-N-Boc-4-Benzyl-D-proline (CAS 158459-13-3), with molecular formula C17H22NO4- and molecular weight 304.15 g/mol. IUPAC: (2R,4R)-4-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylate.
Chemical Property Profile of (4R)-1-N-Boc-4-Benzyl-D-proline
Property Insights of (4R)-1-N-Boc-4-Benzyl-D-proline
The XLogP value of 1.6046 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4R)-1-N-Boc-4-Benzyl-D-proline. The TPSA of 69.67 Ų falls within the moderate polarity range, balancing permeability and solubility for (4R)-1-N-Boc-4-Benzyl-D-proline. Following Lipinski's Rule of Five, (4R)-1-N-Boc-4-Benzyl-D-proline has 0 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 (4R)-1-N-Boc-4-Benzyl-D-proline?
The CAS number of (4R)-1-N-Boc-4-Benzyl-D-proline is 158459-13-3.
What is the molecular formula of (4R)-1-N-Boc-4-Benzyl-D-proline?
The molecular formula of (4R)-1-N-Boc-4-Benzyl-D-proline is C17H22NO4-.
What is the molecular weight of (4R)-1-N-Boc-4-Benzyl-D-proline?
The molecular weight of (4R)-1-N-Boc-4-Benzyl-D-proline is 304.15 g/mol.
Where can I buy (4R)-1-N-Boc-4-Benzyl-D-proline?
You can request a quote for (4R)-1-N-Boc-4-Benzyl-D-proline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4R)-1-N-Boc-4-Benzyl-D-proline?
Yes, KEHONG BIO provides custom synthesis services for (4R)-1-N-Boc-4-Benzyl-D-proline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.