1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol
TL;DR: 1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol (CAS 8048-39-3) is a chemical compound with molecular formula C14H25N5O7 and molecular weight 375.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-7H-purine-2,6-dione;6-(methylamino)hexane-1,2,3,4,5-pentol
Also Known As: THEOPHYLLINE-MEGLUMINE, 1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol
| Molecular Formula | C14H25N5O7 |
|---|---|
| Molecular Weight | 375.18 g/mol |
| LogP | -4.4 |
| Topological Polar Surface Area | 182.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 375.17538 |
| Heavy Atoms | 26 |
| Complexity | 401.0 |
Chemical Identifiers
| CAS Number | 8048-39-3 |
|---|---|
| SMILES | CNCC(C(C(C(CO)O)O)O)O.CN1C2=C(C(=O)N(C1=O)C)NC=N2 |
| InChIKey | SYVYGLNOQIZPJI-UHFFFAOYSA-N |
Product Overview
1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol (CAS 8048-39-3), with molecular formula C14H25N5O7 and molecular weight 375.18 g/mol. IUPAC: 1,3-dimethyl-7H-purine-2,6-dione;6-(methylamino)hexane-1,2,3,4,5-pentol.
Chemical Property Profile of 1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol
Property Insights of 1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol
The XLogP value of -4.4 indicates that 1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 182.0 Ų indicates high polarity, suggesting 1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol has 7 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol?
The CAS number of 1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol is 8048-39-3.
What is the molecular formula of 1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol?
The molecular formula of 1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol is C14H25N5O7.
What is the molecular weight of 1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol?
The molecular weight of 1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol is 375.18 g/mol.
Where can I buy 1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol?
You can request a quote for 1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol?
Yes, KEHONG BIO provides custom synthesis services for 1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.