Benzyloxycarbonyl-phenylalanyl-dehydrophenylalanine
TL;DR: Benzyloxycarbonyl-phenylalanyl-dehydrophenylalanine (CAS 88463-10-9) is a chemical compound with molecular formula C26H24N2O5 and molecular weight 444.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-phenyl-2-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]prop-2-enoic acid
Also Known As: Z-Phe-(Z)-deltaphe, Benzyloxycarbonyl-phenylalanyl-dehydrophenylalanine, (E)-3-phenyl-2-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]prop-2-enoic acid, RefChem:118965
| Molecular Formula | C26H24N2O5 |
|---|---|
| Molecular Weight | 444.17 g/mol |
| LogP | 3.766 |
| Topological Polar Surface Area | 104.73 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 444.16852 |
| Heavy Atoms | 33 |
| Complexity | 1099.3007 |
Chemical Identifiers
| CAS Number | 88463-10-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C[C@@H](C(=O)N/C(=C/C2=CC=CC=C2)/C(=O)O)NC(=O)OCC3=CC=CC=C3 |
Product Overview
Benzyloxycarbonyl-phenylalanyl-dehydrophenylalanine (CAS 88463-10-9), with molecular formula C26H24N2O5 and molecular weight 444.17 g/mol. IUPAC: (E)-3-phenyl-2-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]prop-2-enoic acid.
Chemical Property Profile of Benzyloxycarbonyl-phenylalanyl-dehydrophenylalanine
Property Insights of Benzyloxycarbonyl-phenylalanyl-dehydrophenylalanine
The XLogP value of 3.766 indicates that Benzyloxycarbonyl-phenylalanyl-dehydrophenylalanine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.73 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyloxycarbonyl-phenylalanyl-dehydrophenylalanine. Following Lipinski's Rule of Five, Benzyloxycarbonyl-phenylalanyl-dehydrophenylalanine 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 Benzyloxycarbonyl-phenylalanyl-dehydrophenylalanine?
The CAS number of Benzyloxycarbonyl-phenylalanyl-dehydrophenylalanine is 88463-10-9.
What is the molecular formula of Benzyloxycarbonyl-phenylalanyl-dehydrophenylalanine?
The molecular formula of Benzyloxycarbonyl-phenylalanyl-dehydrophenylalanine is C26H24N2O5.
What is the molecular weight of Benzyloxycarbonyl-phenylalanyl-dehydrophenylalanine?
The molecular weight of Benzyloxycarbonyl-phenylalanyl-dehydrophenylalanine is 444.17 g/mol.
Where can I buy Benzyloxycarbonyl-phenylalanyl-dehydrophenylalanine?
You can request a quote for Benzyloxycarbonyl-phenylalanyl-dehydrophenylalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyloxycarbonyl-phenylalanyl-dehydrophenylalanine?
Yes, KEHONG BIO provides custom synthesis services for Benzyloxycarbonyl-phenylalanyl-dehydrophenylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.