RefChem:1063155
TL;DR: RefChem:1063155 (CAS 78960-58-4) is a chemical compound with molecular formula C15H17N7O7 and molecular weight 407.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2,3-dihydroxypropyl)-1,3-dimethyl-8-[(2E)-2-[(5-nitrofuran-2-yl)methylidene]hydrazinyl]purine-2,6-dione
Also Known As: 2-Furaldehyde, 5-nitro-, (7-(2,3-dihydroxypropyl)-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropurin-8-yl)hydrazone, 5-Nitro-2-furaldehyde [7-(2,3-dihydroxypropyl)-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-8-yl]hydrazone, 7-(2,3-dihydroxypropyl)-1,3-dimethyl-8-{2-[(5-nitrofuran-2-yl)methylidene]hydrazin-1-yl}-2,3,6,7-tetrahydro-1H-purine-2,6-dione, RefChem:1063155, BRN 5187937
| Molecular Formula | C15H17N7O7 |
|---|---|
| Molecular Weight | 407.12 g/mol |
| LogP | -1.2659 |
| Topological Polar Surface Area | 182.95 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 407.11896 |
| Heavy Atoms | 29 |
| Complexity | 1216.2798 |
Chemical Identifiers
| CAS Number | 78960-58-4 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N/N=C/C3=CC=C(O3)[N+](=O)[O-])CC(CO)O |
Product Overview
RefChem:1063155 (CAS 78960-58-4), with molecular formula C15H17N7O7 and molecular weight 407.12 g/mol. IUPAC: 7-(2,3-dihydroxypropyl)-1,3-dimethyl-8-[(2E)-2-[(5-nitrofuran-2-yl)methylidene]hydrazinyl]purine-2,6-dione.
Chemical Property Profile of RefChem:1063155
Property Insights of RefChem:1063155
The XLogP value of -1.2659 indicates that RefChem:1063155 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 182.95 Ų indicates high polarity, suggesting RefChem:1063155 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1063155 has 3 hydrogen bond donor(s) and 10 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 RefChem:1063155?
The CAS number of RefChem:1063155 is 78960-58-4.
What is the molecular formula of RefChem:1063155?
The molecular formula of RefChem:1063155 is C15H17N7O7.
What is the molecular weight of RefChem:1063155?
The molecular weight of RefChem:1063155 is 407.12 g/mol.
Where can I buy RefChem:1063155?
You can request a quote for RefChem:1063155 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1063155?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1063155 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.