Uroporphyrin III octamethyl ester
TL;DR: Uroporphyrin III octamethyl ester (CAS 15435-60-6) is a chemical compound with molecular formula C48H54N4O16 and molecular weight 942.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[3,8,13,17-tetrakis(2-methoxy-2-oxoethyl)-7,12,18-tris(3-methoxy-3-oxopropyl)-21,24-dihydroporphyrin-2-yl]propanoate
Also Known As: Uroporphyrin III octamethyl ester, UroporphyrinIIIoctamethylester, Uroporphyrin III, octamethyl ester, EINECS 239-447-3, 2,7,12,18-Tetramethyl 3,8,13,17-tetrakis(2-methoxy-2-oxoethyl)-21H,23H-porphine-2,7,12,18-tetrapropanoate
| Molecular Formula | C48H54N4O16 |
|---|---|
| Molecular Weight | 942.35 g/mol |
| LogP | 4.8112 |
| Topological Polar Surface Area | 267.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 20 |
| Exact Mass | 942.35345 |
| Heavy Atoms | 68 |
| Complexity | 2740.8977 |
Chemical Identifiers
| CAS Number | 15435-60-6 |
|---|---|
| SMILES | COC(=O)CCC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)CCC(=O)OC)CC(=O)OC)C(=C4CCC(=O)OC)CC(=O)OC)C(=C3CCC(=O)OC)CC(=O)OC)CC(=O)OC |
Product Overview
Uroporphyrin III octamethyl ester (CAS 15435-60-6), with molecular formula C48H54N4O16 and molecular weight 942.35 g/mol. IUPAC: methyl 3-[3,8,13,17-tetrakis(2-methoxy-2-oxoethyl)-7,12,18-tris(3-methoxy-3-oxopropyl)-21,24-dihydroporphyrin-2-yl]propanoate.
Chemical Property Profile of Uroporphyrin III octamethyl ester
Property Insights of Uroporphyrin III octamethyl ester
The XLogP value of 4.8112 indicates that Uroporphyrin III octamethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 267.76 Ų indicates high polarity, suggesting Uroporphyrin III octamethyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Uroporphyrin III octamethyl ester has 2 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 III octamethyl ester?
The CAS number of Uroporphyrin III octamethyl ester is 15435-60-6.
What is the molecular formula of Uroporphyrin III octamethyl ester?
The molecular formula of Uroporphyrin III octamethyl ester is C48H54N4O16.
What is the molecular weight of Uroporphyrin III octamethyl ester?
The molecular weight of Uroporphyrin III octamethyl ester is 942.35 g/mol.
Where can I buy Uroporphyrin III octamethyl ester?
You can request a quote for Uroporphyrin III octamethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Uroporphyrin III octamethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Uroporphyrin III octamethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.