VU0176778-4
TL;DR: VU0176778-4 (CAS 364338-49-8) is a chemical compound with molecular formula C19H16Cl2N4O4 and molecular weight 434.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3,4-dichlorophenyl)methyl]-8-(furan-2-ylmethoxy)-3,7-dimethylpurine-2,6-dione
Also Known As: VU0176778-4, 1-(3,4-dichlorobenzyl)-8-(furan-2-ylmethoxy)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione, 1-(3,4-dichlorobenzyl)-8-(furan-2-ylmethoxy)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione, 1-[(3,4-dichlorophenyl)methyl]-8-(furan-2-ylmethoxy)-3,7-dimethylpurine-2,6-dione
| Molecular Formula | C19H16Cl2N4O4 |
|---|---|
| Molecular Weight | 434.05 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 80.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 434.05487 |
| Heavy Atoms | 29 |
| Complexity | 641.0 |
Chemical Identifiers
| CAS Number | 364338-49-8 |
|---|---|
| SMILES | CN1C2=C(N=C1OCC3=CC=CO3)N(C(=O)N(C2=O)CC4=CC(=C(C=C4)Cl)Cl)C |
| InChIKey | DGPWBQIRROIGLF-UHFFFAOYSA-N |
Product Overview
VU0176778-4 (CAS 364338-49-8), with molecular formula C19H16Cl2N4O4 and molecular weight 434.05 g/mol. IUPAC: 1-[(3,4-dichlorophenyl)methyl]-8-(furan-2-ylmethoxy)-3,7-dimethylpurine-2,6-dione.
Chemical Property Profile of VU0176778-4
Property Insights of VU0176778-4
The XLogP value of 3.2 indicates that VU0176778-4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.8 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0176778-4. Following Lipinski's Rule of Five, VU0176778-4 has 0 hydrogen bond donor(s) and 5 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 VU0176778-4?
The CAS number of VU0176778-4 is 364338-49-8.
What is the molecular formula of VU0176778-4?
The molecular formula of VU0176778-4 is C19H16Cl2N4O4.
What is the molecular weight of VU0176778-4?
The molecular weight of VU0176778-4 is 434.05 g/mol.
Where can I buy VU0176778-4?
You can request a quote for VU0176778-4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0176778-4?
Yes, KEHONG BIO provides custom synthesis services for VU0176778-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.