J1.567.430J
TL;DR: J1.567.430J (CAS 358968-42-0) is a chemical compound with molecular formula C14H18N6O6 and molecular weight 366.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)hydrazinylidene]propanedioate
Also Known As: J1.567.430J, [2-(Theophyline-8-yl)hydrazono]malonic acid diethyl ester, Diethyl 2-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)hydrazinylidene]propanedioate, 1,3-DIETHYL 2-[2-(1,3-DIMETHYL-2,6-DIOXO-2,3,6,7-TETRAHYDRO-1H-PURIN-8-YL)HYDRAZIN-1-YLIDENE]PROPANEDIOATE, diethyl 2-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)hydrazono)malonate
| Molecular Formula | C14H18N6O6 |
|---|---|
| Molecular Weight | 366.13 g/mol |
| LogP | -1.1456 |
| Topological Polar Surface Area | 149.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 366.12878 |
| Heavy Atoms | 26 |
| Complexity | 977.74646 |
Chemical Identifiers
| CAS Number | 358968-42-0 |
|---|---|
| SMILES | CCOC(=O)C(=NNC1=NC2=C(N1)C(=O)N(C(=O)N2C)C)C(=O)OCC |
Product Overview
J1.567.430J (CAS 358968-42-0), with molecular formula C14H18N6O6 and molecular weight 366.13 g/mol. IUPAC: diethyl 2-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)hydrazinylidene]propanedioate.
Chemical Property Profile of J1.567.430J
Property Insights of J1.567.430J
The XLogP value of -1.1456 indicates that J1.567.430J is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 149.67 Ų indicates high polarity, suggesting J1.567.430J may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, J1.567.430J has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of J1.567.430J?
The CAS number of J1.567.430J is 358968-42-0.
What is the molecular formula of J1.567.430J?
The molecular formula of J1.567.430J is C14H18N6O6.
What is the molecular weight of J1.567.430J?
The molecular weight of J1.567.430J is 366.13 g/mol.
Where can I buy J1.567.430J?
You can request a quote for J1.567.430J directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J1.567.430J?
Yes, KEHONG BIO provides custom synthesis services for J1.567.430J and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.