![1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline structure](/static/products/6418/64187-33-3.webp)
1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline
TL;DR: 1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline (CAS 64187-33-3) is a chemical compound with molecular formula C15H17Br2NO4 and molecular weight 432.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,2-dibromoethyl)-1-phenylmethoxycarbonylpyrrolidine-2-carboxylic acid
Also Known As: N-Carbobenzoxy-L-proline 1,2-dibromoethyl ester, N-Carbobenzoxy-L-proline-1,2-dibromoethyl ester, 1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline, 1,2-Pyrrolidinedicarboxylic acid, 1-benzyl 2-(1,2-dibromoethyl) ester, 1,2-Pyrrolidinedicarboxylic acid, 2-(1,2-dibromoethyl) 1-(phenylmethyl) ester
| Molecular Formula | C15H17Br2NO4 |
|---|---|
| Molecular Weight | 432.95 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 432.95242 |
| Heavy Atoms | 22 |
| Complexity | 414.0 |
Chemical Identifiers
| CAS Number | 64187-33-3 |
|---|---|
| SMILES | C1CC(N(C1)C(=O)OCC2=CC=CC=C2)(C(CBr)Br)C(=O)O |
| InChIKey | NIFJDFBYJBPENE-UHFFFAOYSA-N |
Product Overview
1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline (CAS 64187-33-3), with molecular formula C15H17Br2NO4 and molecular weight 432.95 g/mol. IUPAC: 2-(1,2-dibromoethyl)-1-phenylmethoxycarbonylpyrrolidine-2-carboxylic acid.
Chemical Property Profile of 1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline
Property Insights of 1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline
The XLogP value of 3.1 indicates that 1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline. Following Lipinski's Rule of Five, 1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline has 1 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 1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline?
The CAS number of 1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline is 64187-33-3.
What is the molecular formula of 1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline?
The molecular formula of 1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline is C15H17Br2NO4.
What is the molecular weight of 1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline?
The molecular weight of 1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline is 432.95 g/mol.
Where can I buy 1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline?
You can request a quote for 1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline?
Yes, KEHONG BIO provides custom synthesis services for 1-[(Benzyloxy)carbonyl]-2-(1,2-dibromoethyl)proline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.