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Methyl 1-[(benzyloxy)carbonyl]prolylalaninate
TL;DR: Methyl 1-[(benzyloxy)carbonyl]prolylalaninate (CAS 3505-84-8) is a chemical compound with molecular formula C17H22N2O5 and molecular weight 334.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-[(1-methoxy-1-oxopropan-2-yl)carbamoyl]pyrrolidine-1-carboxylate
Also Known As: Methyl 1-[(benzyloxy)carbonyl]prolylalaninate, N-Benzyloxycarbonyl-prolyl-alanine methyl ester, benzyl 2-{[(2-methoxy-1-methyl-2-oxoethyl)amino]carbonyl}-1-pyrrolidinecarboxylate, benzyl 2-[(1-methoxy-1-oxopropan-2-yl)carbamoyl]pyrrolidine-1-carboxylate, 1-Pyrrolidinecarboxylic acid, 2-[(1-carboxyethyl)carbamoyl]-, 1-benzyl 2-methyl ester
| Molecular Formula | C17H22N2O5 |
|---|---|
| Molecular Weight | 334.15 g/mol |
| LogP | 1.4653 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.15286 |
| Heavy Atoms | 24 |
| Complexity | 589.9035 |
Chemical Identifiers
| CAS Number | 3505-84-8 |
|---|---|
| SMILES | CC(C(=O)OC)NC(=O)C1CCCN1C(=O)OCC2=CC=CC=C2 |
Product Overview
Methyl 1-[(benzyloxy)carbonyl]prolylalaninate (CAS 3505-84-8), with molecular formula C17H22N2O5 and molecular weight 334.15 g/mol. IUPAC: benzyl 2-[(1-methoxy-1-oxopropan-2-yl)carbamoyl]pyrrolidine-1-carboxylate.
Chemical Property Profile of Methyl 1-[(benzyloxy)carbonyl]prolylalaninate
Property Insights of Methyl 1-[(benzyloxy)carbonyl]prolylalaninate
The XLogP value of 1.4653 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 1-[(benzyloxy)carbonyl]prolylalaninate. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 1-[(benzyloxy)carbonyl]prolylalaninate. Following Lipinski's Rule of Five, Methyl 1-[(benzyloxy)carbonyl]prolylalaninate 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 1-[(benzyloxy)carbonyl]prolylalaninate?
The CAS number of Methyl 1-[(benzyloxy)carbonyl]prolylalaninate is 3505-84-8.
What is the molecular formula of Methyl 1-[(benzyloxy)carbonyl]prolylalaninate?
The molecular formula of Methyl 1-[(benzyloxy)carbonyl]prolylalaninate is C17H22N2O5.
What is the molecular weight of Methyl 1-[(benzyloxy)carbonyl]prolylalaninate?
The molecular weight of Methyl 1-[(benzyloxy)carbonyl]prolylalaninate is 334.15 g/mol.
Where can I buy Methyl 1-[(benzyloxy)carbonyl]prolylalaninate?
You can request a quote for Methyl 1-[(benzyloxy)carbonyl]prolylalaninate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 1-[(benzyloxy)carbonyl]prolylalaninate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 1-[(benzyloxy)carbonyl]prolylalaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.