(E)-1-(3,4-dichlorobenzyl)-3,7-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione
TL;DR: (E)-1-(3,4-dichlorobenzyl)-3,7-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione (CAS 577694-03-2) is a chemical compound with molecular formula C24H24Cl2N6O5 and molecular weight 546.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3,4-dichlorophenyl)methyl]-3,7-dimethyl-8-[(2E)-2-[(3,4,5-trimethoxyphenyl)methylidene]hydrazinyl]purine-2,6-dione
Also Known As: (E)-1-(3,4-dichlorobenzyl)-3,7-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione, (8E)-1-(3,4-dichlorobenzyl)-3,7-dimethyl-8-[(2E)-(3,4,5-trimethoxybenzylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione, 1-[(3,4-dichlorophenyl)methyl]-3,7-dimethyl-8-[(2E)-2-[(3,4,5-trimethoxyphenyl)methylidene]hydrazinyl]purine-2,6-dione
| Molecular Formula | C24H24Cl2N6O5 |
|---|---|
| Molecular Weight | 546.12 g/mol |
| LogP | 3.2606 |
| Topological Polar Surface Area | 113.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 546.1185 |
| Heavy Atoms | 37 |
| Complexity | 1614.6132 |
Chemical Identifiers
| CAS Number | 577694-03-2 |
|---|---|
| SMILES | CN1C2=C(N=C1N/N=C/C3=CC(=C(C(=C3)OC)OC)OC)N(C(=O)N(C2=O)CC4=CC(=C(C=C4)Cl)Cl)C |
Product Overview
(E)-1-(3,4-dichlorobenzyl)-3,7-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione (CAS 577694-03-2), with molecular formula C24H24Cl2N6O5 and molecular weight 546.12 g/mol. IUPAC: 1-[(3,4-dichlorophenyl)methyl]-3,7-dimethyl-8-[(2E)-2-[(3,4,5-trimethoxyphenyl)methylidene]hydrazinyl]purine-2,6-dione.
Chemical Property Profile of (E)-1-(3,4-dichlorobenzyl)-3,7-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione
Property Insights of (E)-1-(3,4-dichlorobenzyl)-3,7-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione
The XLogP value of 3.2606 indicates that (E)-1-(3,4-dichlorobenzyl)-3,7-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-1-(3,4-dichlorobenzyl)-3,7-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione. Following Lipinski's Rule of Five, (E)-1-(3,4-dichlorobenzyl)-3,7-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)-1-(3,4-dichlorobenzyl)-3,7-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione?
The CAS number of (E)-1-(3,4-dichlorobenzyl)-3,7-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione is 577694-03-2.
What is the molecular formula of (E)-1-(3,4-dichlorobenzyl)-3,7-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione?
The molecular formula of (E)-1-(3,4-dichlorobenzyl)-3,7-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione is C24H24Cl2N6O5.
What is the molecular weight of (E)-1-(3,4-dichlorobenzyl)-3,7-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione?
The molecular weight of (E)-1-(3,4-dichlorobenzyl)-3,7-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione is 546.12 g/mol.
Where can I buy (E)-1-(3,4-dichlorobenzyl)-3,7-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione?
You can request a quote for (E)-1-(3,4-dichlorobenzyl)-3,7-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)-1-(3,4-dichlorobenzyl)-3,7-dimethyl-8-(2-(3,4,5-trimethoxybenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione?
Yes, KEHONG BIO provides custom synthesis services for (E)-1-(3,4-dichlorobenzyl)-3,7-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.