Atx 70
TL;DR: Atx 70 (CAS 135099-39-7) is a chemical compound with molecular formula C62H85GaN6O12 and molecular weight 1174.55 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Atx 70
gallium;2-[3-[8,13-bis(1-decoxyethyl)-18-[3-(1,2-dicarboxylatoethylamino)-3-oxopropyl]-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoylamino]butanedioate;hydron
Also Known As: Atx 70, 2,4-Bis(1-decyloxyethyl)-Ga(III)-1,3,5,8-tetramethylporphyrin-6,7-dipropionyl diaspartic acid, Gallate(3-), ((N,N'-((7,12-bis(1-(decyloxy)ethyl)-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-diyl)bis(1-oxo-3,1-Propanediyl))bis(L-aspartato))(6-)-N21,N22,N23,N24)-, trihydrogen, (SP-4-2)-, gallium; 2-[3-[8,13-bis(1-decoxyethyl)-18-[3-[(1,4-dioxido-1,4-dioxobutan-2-yl)amino]-3-oxopropyl]-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoylamino]butanedioate; hydron, gallium;2-[3-[8,13-bis(1-decoxyethyl)-18-[3-(1,2-dicarboxylatoethylamino)-3-oxopropyl]-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoylamino]butanedioate;hydron
| Molecular Formula | C62H85GaN6O12 |
|---|---|
| Molecular Weight | 1174.55 g/mol |
| LogP | 5.71414 |
| Topological Polar Surface Area | 265.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 32 |
| Exact Mass | 1174.5481 |
| Heavy Atoms | 81 |
| Complexity | 1890.0 |
Chemical Identifiers
| CAS Number | 135099-39-7 |
|---|---|
| SMILES | [H+].[H+].[H+].CCCCCCCCCCOC(C)C1=C(C2=NC1=CC3=C(C(=C([N-]3)C=C4C(=C(C(=CC5=NC(=C2)C(=C5C)C(C)OCCCCCCCCCC)[N-]4)C)CCC(=O)NC(CC(=O)[O-])C(=O)[O-])CCC(=O)NC(CC(=O)[O-])C(=O)[O-])C)C.[Ga+3] |
| InChIKey | WPEFUMGLIZEXIR-UHFFFAOYSA-K |
Product Overview
Atx 70 (CAS 135099-39-7), with molecular formula C62H85GaN6O12 and molecular weight 1174.55 g/mol. IUPAC: gallium;2-[3-[8,13-bis(1-decoxyethyl)-18-[3-(1,2-dicarboxylatoethylamino)-3-oxopropyl]-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoylamino]butanedioate;hydron.
Chemical Property Profile of Atx 70
Property Insights of Atx 70
The XLogP value of 5.71414 indicates that Atx 70 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 265.0 Ų indicates high polarity, suggesting Atx 70 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Atx 70 has 5 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Atx 70?
The CAS number of Atx 70 is 135099-39-7.
What is the molecular formula of Atx 70?
The molecular formula of Atx 70 is C62H85GaN6O12.
What is the molecular weight of Atx 70?
The molecular weight of Atx 70 is 1174.55 g/mol.
Where can I buy Atx 70?
You can request a quote for Atx 70 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Atx 70?
Yes, KEHONG BIO provides custom synthesis services for Atx 70 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.