Methyl phaeophorbide
TL;DR: Methyl phaeophorbide (CAS 5594-30-9) is a chemical compound with molecular formula C36H38N4O5 and molecular weight 606.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 16-ethenyl-11-ethyl-4-hydroxy-22-(3-methoxy-3-oxopropyl)-12,17,21,26-tetramethyl-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,4,6,8(26),9,11,13(25),14,16,18(24),19-undecaene-3-carboxylate
Also Known As: Methyl phaeophorbide, Methyl pheophorbide a, Methylpheophorbide, Methylpheophorbide A, methyl pheophorbide-a
| Molecular Formula | C36H38N4O5 |
|---|---|
| Molecular Weight | 606.28 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 606.28424 |
| Heavy Atoms | 45 |
| Complexity | 1830.0 |
Chemical Identifiers
| CAS Number | 5594-30-9 |
|---|---|
| SMILES | CCC1=C(C2=NC1=CC3=C(C4=C(C(C(=C5C(C(C(=CC6=NC(=C2)C(=C6C)C=C)N5)C)CCC(=O)OC)C4=N3)C(=O)OC)O)C)C |
| InChIKey | HUXSMOZWPXDRTN-UHFFFAOYSA-N |
Product Overview
Methyl phaeophorbide (CAS 5594-30-9), with molecular formula C36H38N4O5 and molecular weight 606.28 g/mol. IUPAC: methyl 16-ethenyl-11-ethyl-4-hydroxy-22-(3-methoxy-3-oxopropyl)-12,17,21,26-tetramethyl-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,4,6,8(26),9,11,13(25),14,16,18(24),19-undecaene-3-carboxylate.
Chemical Property Profile of Methyl phaeophorbide
Property Insights of Methyl phaeophorbide
The XLogP value of 3.1 indicates that Methyl phaeophorbide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl phaeophorbide. Following Lipinski's Rule of Five, Methyl phaeophorbide has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl phaeophorbide?
The CAS number of Methyl phaeophorbide is 5594-30-9.
What is the molecular formula of Methyl phaeophorbide?
The molecular formula of Methyl phaeophorbide is C36H38N4O5.
What is the molecular weight of Methyl phaeophorbide?
The molecular weight of Methyl phaeophorbide is 606.28 g/mol.
Where can I buy Methyl phaeophorbide?
You can request a quote for Methyl phaeophorbide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl phaeophorbide?
Yes, KEHONG BIO provides custom synthesis services for Methyl phaeophorbide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.