Hematoferriheme
TL;DR: Hematoferriheme (CAS 70086-81-6) is a chemical compound with molecular formula C34H37FeN4O7 and molecular weight 669.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[18-(2-carboxylatoethyl)-8,13-bis(1-hydroxyethyl)-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoate;hydron;iron(3+);hydroxide
Also Known As: Hematoferriheme, 3-[18-(2-carboxylatoethyl)-8,13-bis(1-hydroxyethyl)-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoate;hydron;iron(3+);hydroxide, 3-[8,13-bis(1-hydroxyethyl)-3,7,12,17-tetramethyl-18-(3-oxido-3-oxopropyl)porphyrin-21,24-diid-2-yl]propanoate; hydron; iron(3+); hydroxide, Ferrate(2-), (7,12-bis(1-hydroxyethyl)-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-dipropanoato(4-)-N(21),N(22),N(23),N(24))hydroxy-, dihydrogen, (SP-5-13)-
| Molecular Formula | C34H37FeN4O7 |
|---|---|
| Molecular Weight | 669.20 g/mol |
| LogP | 2.22354 |
| Topological Polar Surface Area | 150.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 669.2012 |
| Heavy Atoms | 46 |
| Complexity | 1010.0 |
Chemical Identifiers
| CAS Number | 70086-81-6 |
|---|---|
| SMILES | [H+].[H+].CC1=C(C2=CC3=C(C(=C([N-]3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1[N-]2)C)C(C)O)C)C(C)O)C)CCC(=O)[O-])CCC(=O)[O-].[OH-].[Fe+3] |
| InChIKey | CJACBYXVYGMBAX-UHFFFAOYSA-K |
Product Overview
Hematoferriheme (CAS 70086-81-6), with molecular formula C34H37FeN4O7 and molecular weight 669.20 g/mol. IUPAC: 3-[18-(2-carboxylatoethyl)-8,13-bis(1-hydroxyethyl)-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoate;hydron;iron(3+);hydroxide.
Chemical Property Profile of Hematoferriheme
Property Insights of Hematoferriheme
The XLogP value of 2.22354 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hematoferriheme. The TPSA of 150.0 Ų indicates high polarity, suggesting Hematoferriheme may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Hematoferriheme has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hematoferriheme?
The CAS number of Hematoferriheme is 70086-81-6.
What is the molecular formula of Hematoferriheme?
The molecular formula of Hematoferriheme is C34H37FeN4O7.
What is the molecular weight of Hematoferriheme?
The molecular weight of Hematoferriheme is 669.20 g/mol.
Where can I buy Hematoferriheme?
You can request a quote for Hematoferriheme directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hematoferriheme?
Yes, KEHONG BIO provides custom synthesis services for Hematoferriheme and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.