Carbobenzyloxy-L-valylglycine benzyl ester
TL;DR: Carbobenzyloxy-L-valylglycine benzyl ester (CAS 57294-39-0) 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.
benzyl 2-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]acetate
Also Known As: CARBOBENZYLOXY-L-VALYLGLYCINE BENZYL ESTER, benzyl 2-(2-{[(benzyloxy)carbonyl]amino}-3-methylbutanamido)acetate, Benzyl 2-[(3-methyl-2-phenylmethoxycarbonylamino-butanoyl)amino]acetate, benzyl 2-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]acetate
| Molecular Formula | C22H26N2O5 |
|---|---|
| Molecular Weight | 398.18 g/mol |
| LogP | 2.797 |
| Topological Polar Surface Area | 93.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 398.18417 |
| Heavy Atoms | 29 |
| Complexity | 793.3646 |
Chemical Identifiers
| CAS Number | 57294-39-0 |
|---|---|
| SMILES | CC(C)C(C(=O)NCC(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2 |
Product Overview
Carbobenzyloxy-L-valylglycine benzyl ester (CAS 57294-39-0), with molecular formula C22H26N2O5 and molecular weight 398.18 g/mol. IUPAC: benzyl 2-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]acetate.
Chemical Property Profile of Carbobenzyloxy-L-valylglycine benzyl ester
Property Insights of Carbobenzyloxy-L-valylglycine benzyl ester
The XLogP value of 2.797 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbobenzyloxy-L-valylglycine benzyl ester. The TPSA of 93.73 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbobenzyloxy-L-valylglycine benzyl ester. Following Lipinski's Rule of Five, Carbobenzyloxy-L-valylglycine benzyl ester has 2 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 Carbobenzyloxy-L-valylglycine benzyl ester?
The CAS number of Carbobenzyloxy-L-valylglycine benzyl ester is 57294-39-0.
What is the molecular formula of Carbobenzyloxy-L-valylglycine benzyl ester?
The molecular formula of Carbobenzyloxy-L-valylglycine benzyl ester is C22H26N2O5.
What is the molecular weight of Carbobenzyloxy-L-valylglycine benzyl ester?
The molecular weight of Carbobenzyloxy-L-valylglycine benzyl ester is 398.18 g/mol.
Where can I buy Carbobenzyloxy-L-valylglycine benzyl ester?
You can request a quote for Carbobenzyloxy-L-valylglycine benzyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbobenzyloxy-L-valylglycine benzyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbobenzyloxy-L-valylglycine benzyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.