Carbobenzyloxy-beta-alanylglycylglycine benzyl ester
TL;DR: Carbobenzyloxy-beta-alanylglycylglycine benzyl ester (CAS 72722-24-8) is a chemical compound with molecular formula C22H25N3O6 and molecular weight 427.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-[[2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetyl]amino]acetate
Also Known As: CARBOBENZYLOXY-BETA-ALANYLGLYCYLGLYCINE BENZYL ESTER, N-Benzyloxycarbonyl-beta-glycylglycylglycine benzyl ester, Benzyl 2-[[2-(3-phenylmethoxycarbonylaminopropanoylamino)acetyl]amino]acetate, benzyl 2-[[2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetyl]amino]acetate, 667-929-7
| Molecular Formula | C22H25N3O6 |
|---|---|
| Molecular Weight | 427.17 g/mol |
| LogP | 1.2787 |
| Topological Polar Surface Area | 122.83 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 427.17435 |
| Heavy Atoms | 31 |
| Complexity | 858.06464 |
Chemical Identifiers
| CAS Number | 72722-24-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)CNC(=O)CNC(=O)CCNC(=O)OCC2=CC=CC=C2 |
Product Overview
Carbobenzyloxy-beta-alanylglycylglycine benzyl ester (CAS 72722-24-8), with molecular formula C22H25N3O6 and molecular weight 427.17 g/mol. IUPAC: benzyl 2-[[2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetyl]amino]acetate.
Chemical Property Profile of Carbobenzyloxy-beta-alanylglycylglycine benzyl ester
Property Insights of Carbobenzyloxy-beta-alanylglycylglycine benzyl ester
The XLogP value of 1.2787 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbobenzyloxy-beta-alanylglycylglycine benzyl ester. The TPSA of 122.83 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbobenzyloxy-beta-alanylglycylglycine benzyl ester. Following Lipinski's Rule of Five, Carbobenzyloxy-beta-alanylglycylglycine benzyl ester has 3 hydrogen bond donor(s) and 6 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-beta-alanylglycylglycine benzyl ester?
The CAS number of Carbobenzyloxy-beta-alanylglycylglycine benzyl ester is 72722-24-8.
What is the molecular formula of Carbobenzyloxy-beta-alanylglycylglycine benzyl ester?
The molecular formula of Carbobenzyloxy-beta-alanylglycylglycine benzyl ester is C22H25N3O6.
What is the molecular weight of Carbobenzyloxy-beta-alanylglycylglycine benzyl ester?
The molecular weight of Carbobenzyloxy-beta-alanylglycylglycine benzyl ester is 427.17 g/mol.
Where can I buy Carbobenzyloxy-beta-alanylglycylglycine benzyl ester?
You can request a quote for Carbobenzyloxy-beta-alanylglycylglycine 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-beta-alanylglycylglycine benzyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbobenzyloxy-beta-alanylglycylglycine benzyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.