(E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione
TL;DR: (E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione (CAS 577984-09-9) is a chemical compound with molecular formula C24H25ClN6O5 and molecular weight 512.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-[(2E)-2-[(3,4,5-trimethoxyphenyl)methylidene]hydrazinyl]purine-2,6-dione
Also Known As: (E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione, (8E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-[(2E)-(3,4,5-trimethoxybenzylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione, 7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-[(2E)-2-[(3,4,5-trimethoxyphenyl)methylidene]hydrazinyl]purine-2,6-dione
| Molecular Formula | C24H25ClN6O5 |
|---|---|
| Molecular Weight | 512.16 g/mol |
| LogP | 2.6072 |
| Topological Polar Surface Area | 113.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 512.1575 |
| Heavy Atoms | 36 |
| Complexity | 1561.6383 |
Chemical Identifiers
| CAS Number | 577984-09-9 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N/N=C/C3=CC(=C(C(=C3)OC)OC)OC)CC4=CC=CC=C4Cl |
Product Overview
(E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione (CAS 577984-09-9), with molecular formula C24H25ClN6O5 and molecular weight 512.16 g/mol. IUPAC: 7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-[(2E)-2-[(3,4,5-trimethoxyphenyl)methylidene]hydrazinyl]purine-2,6-dione.
Chemical Property Profile of (E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione
Property Insights of (E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione
The XLogP value of 2.6072 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione. The TPSA of 113.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione. Following Lipinski's Rule of Five, (E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione?
The CAS number of (E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione is 577984-09-9.
What is the molecular formula of (E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione?
The molecular formula of (E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione is C24H25ClN6O5.
What is the molecular weight of (E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione?
The molecular weight of (E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione is 512.16 g/mol.
Where can I buy (E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione?
You can request a quote for (E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione?
Yes, KEHONG BIO provides custom synthesis services for (E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.