Zn(II) Aetiopurpurin
TL;DR: Zn(II) Aetiopurpurin (CAS 113031-38-2) is a chemical compound with molecular formula C37H42N4O2Zn and molecular weight 638.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
zinc ethoxy-(5,11,16,21-tetraethyl-12,17,22,26-tetramethyl-7,24,25-triaza-23-azanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(22),2,6,8,10(25),11,13,15(24),16,18,20-undecaen-4-ylidene)methanolate
Also Known As: Zn(II) Aetiopurpurin, ZnET2, zinc;ethoxy-(5,11,16,21-tetraethyl-12,17,22,26-tetramethyl-7,24,25-triaza-23-azanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(22),2,6,8,10(25),11,13,15(24),16,18,20-undecaen-4-ylidene)methanolate, Zinc ethoxy(4,9,14,19-tetraethyl-3,8,13,18-tetramethyl-3,4,23,25-tetradehydro-18,19-dihydro-20H-phorbin-26-id-20-ylidene)methanolate, Zinc, (ethyl 3,4,20,21-tetradehydro-4,9,14,19-tetraethyl-18,19-dihydro-3,8,13,18-tetramethyl-20-phorbinecarboxylato(2-)-N23,N24,N25,N26)-, (SP-4-2)-
| Molecular Formula | C37H42N4O2Zn |
|---|---|
| Molecular Weight | 638.26 g/mol |
| LogP | 7.48912 |
| Topological Polar Surface Area | 70.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 638.2599 |
| Heavy Atoms | 44 |
| Complexity | 1570.0 |
Chemical Identifiers
| CAS Number | 113031-38-2 |
|---|---|
| SMILES | CCC1=C(C2=CC3=NC(=CC4=C(C(=C([N-]4)C5=CC(=C([O-])OCC)C6(C5=NC(=CC1=N2)C6C)CC)C)CC)C(=C3CC)C)C.[Zn+2] |
| InChIKey | YRNBDJIIWYRJFX-UHFFFAOYSA-M |
Product Overview
Zn(II) Aetiopurpurin (CAS 113031-38-2), with molecular formula C37H42N4O2Zn and molecular weight 638.26 g/mol. IUPAC: zinc ethoxy-(5,11,16,21-tetraethyl-12,17,22,26-tetramethyl-7,24,25-triaza-23-azanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(22),2,6,8,10(25),11,13,15(24),16,18,20-undecaen-4-ylidene)methanolate.
Chemical Property Profile of Zn(II) Aetiopurpurin
Property Insights of Zn(II) Aetiopurpurin
The XLogP value of 7.48912 indicates that Zn(II) Aetiopurpurin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Zn(II) Aetiopurpurin. Following Lipinski's Rule of Five, Zn(II) Aetiopurpurin has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Zn(II) Aetiopurpurin?
The CAS number of Zn(II) Aetiopurpurin is 113031-38-2.
What is the molecular formula of Zn(II) Aetiopurpurin?
The molecular formula of Zn(II) Aetiopurpurin is C37H42N4O2Zn.
What is the molecular weight of Zn(II) Aetiopurpurin?
The molecular weight of Zn(II) Aetiopurpurin is 638.26 g/mol.
Where can I buy Zn(II) Aetiopurpurin?
You can request a quote for Zn(II) Aetiopurpurin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Zn(II) Aetiopurpurin?
Yes, KEHONG BIO provides custom synthesis services for Zn(II) Aetiopurpurin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.