Uroporphyrin I dihydrochloride
TL;DR: Uroporphyrin I dihydrochloride (CAS 68929-06-6) is a chemical compound with molecular formula C40H40Cl2N4O16 and molecular weight 902.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[7,12,17-tris(2-carboxyethyl)-3,8,13,18-tetrakis(carboxymethyl)-21,24-dihydroporphyrin-2-yl]propanoic acid;dihydrochloride
Also Known As: Uroporphyrin I dihydrochloride, Uroporphyrin I, UroporphyrinIdihydrochloride, 21H,23H-Porphine-2,7,12,17-tetrapropanoic acid, 3,8,13,18-tetrakis(carboxymethyl)-, dihydrochloride, 21H,23H-Porphine-2,7,12,17-tetrapropanoic acid, 3,8,13,18-tetrakis(carboxymethyl)-, hydrochloride (1:2)
| Molecular Formula | C40H40Cl2N4O16 |
|---|---|
| Molecular Weight | 902.18 g/mol |
| LogP | 4.95 |
| Topological Polar Surface Area | 356.0 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 20 |
| Exact Mass | 902.18164 |
| Heavy Atoms | 62 |
| Complexity | 1630.0 |
Chemical Identifiers
| CAS Number | 68929-06-6 |
|---|---|
| SMILES | C1=C2C(=C(C(=CC3=NC(=CC4=NC(=CC5=C(C(=C1N5)CC(=O)O)CCC(=O)O)C(=C4CCC(=O)O)CC(=O)O)C(=C3CCC(=O)O)CC(=O)O)N2)CC(=O)O)CCC(=O)O.Cl.Cl |
| InChIKey | PCBBNDJUGHWSIE-UHFFFAOYSA-N |
Product Overview
Uroporphyrin I dihydrochloride (CAS 68929-06-6), with molecular formula C40H40Cl2N4O16 and molecular weight 902.18 g/mol. IUPAC: 3-[7,12,17-tris(2-carboxyethyl)-3,8,13,18-tetrakis(carboxymethyl)-21,24-dihydroporphyrin-2-yl]propanoic acid;dihydrochloride.
Chemical Property Profile of Uroporphyrin I dihydrochloride
Property Insights of Uroporphyrin I dihydrochloride
The XLogP value of 4.95 indicates that Uroporphyrin I dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 356.0 Ų indicates high polarity, suggesting Uroporphyrin I dihydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Uroporphyrin I dihydrochloride has 12 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Uroporphyrin I dihydrochloride?
The CAS number of Uroporphyrin I dihydrochloride is 68929-06-6.
What is the molecular formula of Uroporphyrin I dihydrochloride?
The molecular formula of Uroporphyrin I dihydrochloride is C40H40Cl2N4O16.
What is the molecular weight of Uroporphyrin I dihydrochloride?
The molecular weight of Uroporphyrin I dihydrochloride is 902.18 g/mol.
Where can I buy Uroporphyrin I dihydrochloride?
You can request a quote for Uroporphyrin I dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Uroporphyrin I dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Uroporphyrin I dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.