Mesoferriheme
TL;DR: Mesoferriheme (CAS 18040-04-5) is a chemical compound with molecular formula C34H36FeN4O4 and molecular weight 620.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[18-(2-carboxylatoethyl)-8,13-diethyl-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoate;hydron;iron(2+)
Also Known As: Mesoferriheme, 3-[18-(2-carboxylatoethyl)-8,13-diethyl-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoate;hydron;iron(2+), 3-[8,13-diethyl-3,7,12,17-tetramethyl-18-(3-oxido-3-oxopropyl)porphyrin-21,24-diid-2-yl]propanoate; hydron; iron(2+), Dihydrogen iron(II) 3,7-bis(2-carboxylatoethyl)-12,17-diethyl-2,8,13,18-tetramethylporphyrin-21,22-diide, Ferrate(2-), (7,12-diethyl-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-dipropanoato(4-)-N21,N22,N23,N24)-, dihydrogen, (SP-4-2)-
| Molecular Formula | C34H36FeN4O4 |
|---|---|
| Molecular Weight | 620.21 g/mol |
| LogP | 4.45874 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 620.2086 |
| Heavy Atoms | 43 |
| Complexity | 937.0 |
Chemical Identifiers
| CAS Number | 18040-04-5 |
|---|---|
| SMILES | [H+].[H+].CCC1=C(C2=NC1=CC3=C(C(=C([N-]3)C=C4C(=C(C(=CC5=NC(=C2)C(=C5C)CC)[N-]4)C)CCC(=O)[O-])CCC(=O)[O-])C)C.[Fe+2] |
| InChIKey | YZTICFPLOXKSQO-UHFFFAOYSA-L |
Product Overview
Mesoferriheme (CAS 18040-04-5), with molecular formula C34H36FeN4O4 and molecular weight 620.21 g/mol. IUPAC: 3-[18-(2-carboxylatoethyl)-8,13-diethyl-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoate;hydron;iron(2+).
Chemical Property Profile of Mesoferriheme
Property Insights of Mesoferriheme
The XLogP value of 4.45874 indicates that Mesoferriheme is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Mesoferriheme. Following Lipinski's Rule of Five, Mesoferriheme has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Mesoferriheme?
The CAS number of Mesoferriheme is 18040-04-5.
What is the molecular formula of Mesoferriheme?
The molecular formula of Mesoferriheme is C34H36FeN4O4.
What is the molecular weight of Mesoferriheme?
The molecular weight of Mesoferriheme is 620.21 g/mol.
Where can I buy Mesoferriheme?
You can request a quote for Mesoferriheme directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mesoferriheme?
Yes, KEHONG BIO provides custom synthesis services for Mesoferriheme and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.