(4R)-Boc-4-(4-bromobenzyl)-L-pyroglutamic acid benzyl ester
TL;DR: (4R)-Boc-4-(4-bromobenzyl)-L-pyroglutamic acid benzyl ester (CAS 401793-01-9) is a chemical compound with molecular formula C24H26BrNO5 and molecular weight 487.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-O-benzyl 1-O-tert-butyl 4-[(4-bromophenyl)methyl]-5-oxopyrrolidine-1,2-dicarboxylate
Also Known As: (4R)-Boc-4-(4-bromobenzyl)-L-pyroglutamic acid benzyl ester, 2-O-benzyl 1-O-tert-butyl 4-[(4-bromophenyl)methyl]-5-oxopyrrolidine-1,2-dicarboxylate, Tert-butyl Benzyl 4-[(4-bromophenyl)methyl]-5-oxo-pyrrolidine-1,2-dicarboxylate
| Molecular Formula | C24H26BrNO5 |
|---|---|
| Molecular Weight | 487.10 g/mol |
| LogP | 4.8872 |
| Topological Polar Surface Area | 72.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 487.09943 |
| Heavy Atoms | 31 |
| Complexity | 936.6921 |
Chemical Identifiers
| CAS Number | 401793-01-9 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1C(CC(C1=O)CC2=CC=C(C=C2)Br)C(=O)OCC3=CC=CC=C3 |
Product Overview
(4R)-Boc-4-(4-bromobenzyl)-L-pyroglutamic acid benzyl ester (CAS 401793-01-9), with molecular formula C24H26BrNO5 and molecular weight 487.10 g/mol. IUPAC: 2-O-benzyl 1-O-tert-butyl 4-[(4-bromophenyl)methyl]-5-oxopyrrolidine-1,2-dicarboxylate.
Chemical Property Profile of (4R)-Boc-4-(4-bromobenzyl)-L-pyroglutamic acid benzyl ester
Property Insights of (4R)-Boc-4-(4-bromobenzyl)-L-pyroglutamic acid benzyl ester
The XLogP value of 4.8872 indicates that (4R)-Boc-4-(4-bromobenzyl)-L-pyroglutamic acid benzyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.91 Ų falls within the moderate polarity range, balancing permeability and solubility for (4R)-Boc-4-(4-bromobenzyl)-L-pyroglutamic acid benzyl ester. Following Lipinski's Rule of Five, (4R)-Boc-4-(4-bromobenzyl)-L-pyroglutamic acid benzyl ester has 0 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 (4R)-Boc-4-(4-bromobenzyl)-L-pyroglutamic acid benzyl ester?
The CAS number of (4R)-Boc-4-(4-bromobenzyl)-L-pyroglutamic acid benzyl ester is 401793-01-9.
What is the molecular formula of (4R)-Boc-4-(4-bromobenzyl)-L-pyroglutamic acid benzyl ester?
The molecular formula of (4R)-Boc-4-(4-bromobenzyl)-L-pyroglutamic acid benzyl ester is C24H26BrNO5.
What is the molecular weight of (4R)-Boc-4-(4-bromobenzyl)-L-pyroglutamic acid benzyl ester?
The molecular weight of (4R)-Boc-4-(4-bromobenzyl)-L-pyroglutamic acid benzyl ester is 487.10 g/mol.
Where can I buy (4R)-Boc-4-(4-bromobenzyl)-L-pyroglutamic acid benzyl ester?
You can request a quote for (4R)-Boc-4-(4-bromobenzyl)-L-pyroglutamic acid benzyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4R)-Boc-4-(4-bromobenzyl)-L-pyroglutamic acid benzyl ester?
Yes, KEHONG BIO provides custom synthesis services for (4R)-Boc-4-(4-bromobenzyl)-L-pyroglutamic acid benzyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.