Benzyloxycarbonyl-prolyl-psi(CN4)-alanine benzyl ester
TL;DR: Benzyloxycarbonyl-prolyl-psi(CN4)-alanine benzyl ester (CAS 134124-09-7) is a chemical compound with molecular formula C23H25N5O4 and molecular weight 435.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl (2S)-2-[2-[(2S)-1-oxo-1-phenylmethoxypropan-2-yl]tetrazol-5-yl]pyrrolidine-1-carboxylate
Also Known As: Z-Pro-psi(CN4)-ala-obz, Benzyloxycarbonyl-prolyl-psi(CN4)-alanine benzyl ester, benzyl (2S)-2-[2-[(2S)-1-oxo-1-phenylmethoxypropan-2-yl]tetrazol-5-yl]pyrrolidine-1-carboxylate, Benzyl 2-{2-[1-(benzyloxy)-1-oxopropan-2-yl]-2H-tetrazol-5-yl}pyrrolidine-1-carboxylate, 2H-Tetrazole-2-acetic acid, alpha-methyl-5-(1-((phenylmethoxy)carbonyl)-2-pyrrolidinyl)-, phenylmethyl ester, (S-(R*,R*))-
| Molecular Formula | C23H25N5O4 |
|---|---|
| Molecular Weight | 435.19 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 99.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 435.19064 |
| Heavy Atoms | 32 |
| Complexity | 624.0 |
Chemical Identifiers
| CAS Number | 134124-09-7 |
|---|---|
| SMILES | C[C@@H](C(=O)OCC1=CC=CC=C1)N2N=C(N=N2)[C@@H]3CCCN3C(=O)OCC4=CC=CC=C4 |
| InChIKey | CTOJUTZJTIAACJ-PXNSSMCTSA-N |
Product Overview
Benzyloxycarbonyl-prolyl-psi(CN4)-alanine benzyl ester (CAS 134124-09-7), with molecular formula C23H25N5O4 and molecular weight 435.19 g/mol. IUPAC: benzyl (2S)-2-[2-[(2S)-1-oxo-1-phenylmethoxypropan-2-yl]tetrazol-5-yl]pyrrolidine-1-carboxylate.
Chemical Property Profile of Benzyloxycarbonyl-prolyl-psi(CN4)-alanine benzyl ester
Property Insights of Benzyloxycarbonyl-prolyl-psi(CN4)-alanine benzyl ester
The XLogP value of 3.8 indicates that Benzyloxycarbonyl-prolyl-psi(CN4)-alanine benzyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyloxycarbonyl-prolyl-psi(CN4)-alanine benzyl ester. Following Lipinski's Rule of Five, Benzyloxycarbonyl-prolyl-psi(CN4)-alanine benzyl ester has 0 hydrogen bond donor(s) and 7 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 Benzyloxycarbonyl-prolyl-psi(CN4)-alanine benzyl ester?
The CAS number of Benzyloxycarbonyl-prolyl-psi(CN4)-alanine benzyl ester is 134124-09-7.
What is the molecular formula of Benzyloxycarbonyl-prolyl-psi(CN4)-alanine benzyl ester?
The molecular formula of Benzyloxycarbonyl-prolyl-psi(CN4)-alanine benzyl ester is C23H25N5O4.
What is the molecular weight of Benzyloxycarbonyl-prolyl-psi(CN4)-alanine benzyl ester?
The molecular weight of Benzyloxycarbonyl-prolyl-psi(CN4)-alanine benzyl ester is 435.19 g/mol.
Where can I buy Benzyloxycarbonyl-prolyl-psi(CN4)-alanine benzyl ester?
You can request a quote for Benzyloxycarbonyl-prolyl-psi(CN4)-alanine benzyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyloxycarbonyl-prolyl-psi(CN4)-alanine benzyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzyloxycarbonyl-prolyl-psi(CN4)-alanine benzyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.