N-Benzyloxycarbonyl-valyl-phenylalanine methyl ester
TL;DR: N-Benzyloxycarbonyl-valyl-phenylalanine methyl ester (CAS 4817-95-2) is a chemical compound with molecular formula C22H26N2O5 and molecular weight 398.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-3-phenylpropanoic acid
Also Known As: Z-VAL-PHE-OH, Z-Val-phe-ome, Cbz-VF-ome, Cbz-Val-Phe-OH, Z-Val-Phe
| Molecular Formula | C22H26N2O5 |
|---|---|
| Molecular Weight | 398.18 g/mol |
| LogP | 2.7495 |
| Topological Polar Surface Area | 104.73 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 398.18417 |
| Heavy Atoms | 29 |
| Complexity | 808.46704 |
Chemical Identifiers
| CAS Number | 4817-95-2 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O)NC(=O)OCC2=CC=CC=C2 |
Product Overview
N-Benzyloxycarbonyl-valyl-phenylalanine methyl ester (CAS 4817-95-2), with molecular formula C22H26N2O5 and molecular weight 398.18 g/mol. IUPAC: (2S)-2-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-3-phenylpropanoic acid.
Chemical Property Profile of N-Benzyloxycarbonyl-valyl-phenylalanine methyl ester
Property Insights of N-Benzyloxycarbonyl-valyl-phenylalanine methyl ester
The XLogP value of 2.7495 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Benzyloxycarbonyl-valyl-phenylalanine methyl ester. The TPSA of 104.73 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Benzyloxycarbonyl-valyl-phenylalanine methyl ester. Following Lipinski's Rule of Five, N-Benzyloxycarbonyl-valyl-phenylalanine methyl ester has 3 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 N-Benzyloxycarbonyl-valyl-phenylalanine methyl ester?
The CAS number of N-Benzyloxycarbonyl-valyl-phenylalanine methyl ester is 4817-95-2.
What is the molecular formula of N-Benzyloxycarbonyl-valyl-phenylalanine methyl ester?
The molecular formula of N-Benzyloxycarbonyl-valyl-phenylalanine methyl ester is C22H26N2O5.
What is the molecular weight of N-Benzyloxycarbonyl-valyl-phenylalanine methyl ester?
The molecular weight of N-Benzyloxycarbonyl-valyl-phenylalanine methyl ester is 398.18 g/mol.
Where can I buy N-Benzyloxycarbonyl-valyl-phenylalanine methyl ester?
You can request a quote for N-Benzyloxycarbonyl-valyl-phenylalanine methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Benzyloxycarbonyl-valyl-phenylalanine methyl ester?
Yes, KEHONG BIO provides custom synthesis services for N-Benzyloxycarbonyl-valyl-phenylalanine methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.