RefChem:504048
TL;DR: RefChem:504048 (CAS 478252-66-3) is a chemical compound with molecular formula C25H21N7O4 and molecular weight 483.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-7-(naphthalen-1-ylmethyl)-8-[(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl]purine-2,6-dione
Also Known As: 3-methyl-7-(1-naphthylmethyl)-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazino}-3,7-dihydro-1H-purine-2,6-dione, 3-Methyl-7-(1-naphthylmethyl)-8-((2E)-2-(1-(4-nitrophenyl)ethylidene)hydrazino)-3,7-dihydro-1H-purine-2,6-dione, 3-methyl-7-(naphthalen-1-ylmethyl)-8-[2-[1-(4-nitrophenyl)ethylidene]hydrazinyl]purine-2,6-dione, 631-638-3, RefChem:504048
| Molecular Formula | C25H21N7O4 |
|---|---|
| Molecular Weight | 483.17 g/mol |
| LogP | 3.3691 |
| Topological Polar Surface Area | 140.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 483.1655 |
| Heavy Atoms | 36 |
| Complexity | 1773.8678 |
Chemical Identifiers
| CAS Number | 478252-66-3 |
|---|---|
| SMILES | C/C(=N\NC1=NC2=C(N1CC3=CC=CC4=CC=CC=C43)C(=O)NC(=O)N2C)/C5=CC=C(C=C5)[N+](=O)[O-] |
Product Overview
RefChem:504048 (CAS 478252-66-3), with molecular formula C25H21N7O4 and molecular weight 483.17 g/mol. IUPAC: 3-methyl-7-(naphthalen-1-ylmethyl)-8-[(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl]purine-2,6-dione.
Chemical Property Profile of RefChem:504048
Property Insights of RefChem:504048
The XLogP value of 3.3691 indicates that RefChem:504048 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 140.21 Ų indicates high polarity, suggesting RefChem:504048 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:504048 has 2 hydrogen bond donor(s) and 7 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:504048?
The CAS number of RefChem:504048 is 478252-66-3.
What is the molecular formula of RefChem:504048?
The molecular formula of RefChem:504048 is C25H21N7O4.
What is the molecular weight of RefChem:504048?
The molecular weight of RefChem:504048 is 483.17 g/mol.
Where can I buy RefChem:504048?
You can request a quote for RefChem:504048 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:504048?
Yes, KEHONG BIO provides custom synthesis services for RefChem:504048 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.