Hematoporphyrin dihydrochloride
TL;DR: Hematoporphyrin dihydrochloride (CAS 77800-85-2) is a chemical compound with molecular formula C34H40Cl2N4O6 and molecular weight 670.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[18-(2-carboxyethyl)-8,13-bis(1-hydroxyethyl)-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoic acid;dihydrochloride
Also Known As: HEMATOPORPHYRIN DIHYDROCHLORIDE, Apiabasilon, Vitamorell, Ematoporfirina, Hematoporphyrin HCl
| Molecular Formula | C34H40Cl2N4O6 |
|---|---|
| Molecular Weight | 670.23 g/mol |
| LogP | 7.47284 |
| Topological Polar Surface Area | 172.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 670.2325 |
| Heavy Atoms | 46 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 77800-85-2 |
|---|---|
| SMILES | CC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)C(C)O)C)C(=C4CCC(=O)O)C)C(=C3C)CCC(=O)O)C(C)O.Cl.Cl |
| InChIKey | WZQQOXSHARXAID-UHFFFAOYSA-N |
Product Overview
Hematoporphyrin dihydrochloride (CAS 77800-85-2), with molecular formula C34H40Cl2N4O6 and molecular weight 670.23 g/mol. IUPAC: 3-[18-(2-carboxyethyl)-8,13-bis(1-hydroxyethyl)-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoic acid;dihydrochloride.
Chemical Property Profile of Hematoporphyrin dihydrochloride
Property Insights of Hematoporphyrin dihydrochloride
The XLogP value of 7.47284 indicates that Hematoporphyrin dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 172.0 Ų indicates high polarity, suggesting Hematoporphyrin dihydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Hematoporphyrin dihydrochloride has 8 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 Hematoporphyrin dihydrochloride?
The CAS number of Hematoporphyrin dihydrochloride is 77800-85-2.
What is the molecular formula of Hematoporphyrin dihydrochloride?
The molecular formula of Hematoporphyrin dihydrochloride is C34H40Cl2N4O6.
What is the molecular weight of Hematoporphyrin dihydrochloride?
The molecular weight of Hematoporphyrin dihydrochloride is 670.23 g/mol.
Where can I buy Hematoporphyrin dihydrochloride?
You can request a quote for Hematoporphyrin dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hematoporphyrin dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Hematoporphyrin dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.