BAS 00396592
TL;DR: BAS 00396592 (CAS 324539-06-2) is a chemical compound with molecular formula C29H28N6O3 and molecular weight 508.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,7-dibenzyl-8-[(2E)-2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl]-3-methylpurine-2,6-dione
Also Known As: BAS 00396592, 1,7-dibenzyl-8-[(2E)-2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl]-3-methylpurine-2,6-dione, 1,7-dibenzyl-8-{2-[1-(4-methoxyphenyl)ethylidene]hydrazino}-3-methyl-3,7-dihydro-1H-purine-2,6-dione, (E)-1,7-dibenzyl-8-(2-(1-(4-methoxyphenyl)ethylidene)hydrazinyl)-3-methyl-1H-purine-2,6(3H,7H)-dione, 1,7-dibenzyl-8-{(2E)-2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C29H28N6O3 |
|---|---|
| Molecular Weight | 508.22 g/mol |
| LogP | 3.838 |
| Topological Polar Surface Area | 95.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 508.2223 |
| Heavy Atoms | 38 |
| Complexity | 1716.771 |
Chemical Identifiers
| CAS Number | 324539-06-2 |
|---|---|
| SMILES | C/C(=N\NC1=NC2=C(N1CC3=CC=CC=C3)C(=O)N(C(=O)N2C)CC4=CC=CC=C4)/C5=CC=C(C=C5)OC |
Product Overview
BAS 00396592 (CAS 324539-06-2), with molecular formula C29H28N6O3 and molecular weight 508.22 g/mol. IUPAC: 1,7-dibenzyl-8-[(2E)-2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl]-3-methylpurine-2,6-dione.
Chemical Property Profile of BAS 00396592
Property Insights of BAS 00396592
The XLogP value of 3.838 indicates that BAS 00396592 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.44 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00396592. Following Lipinski's Rule of Five, BAS 00396592 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00396592?
The CAS number of BAS 00396592 is 324539-06-2.
What is the molecular formula of BAS 00396592?
The molecular formula of BAS 00396592 is C29H28N6O3.
What is the molecular weight of BAS 00396592?
The molecular weight of BAS 00396592 is 508.22 g/mol.
Where can I buy BAS 00396592?
You can request a quote for BAS 00396592 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00396592?
Yes, KEHONG BIO provides custom synthesis services for BAS 00396592 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.