VU0509539-1
TL;DR: VU0509539-1 (CAS 904371-97-7) is a chemical compound with molecular formula C21H25N5O3 and molecular weight 395.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-ethoxyphenyl)-4,7-dimethyl-2-(2-methylpropyl)purino[7,8-a]imidazole-1,3-dione
Also Known As: VU0509539-1, F3124-0158, 6-(2-ethoxyphenyl)-4,7-dimethyl-2-(2-methylpropyl)purino[7,8-a]imidazole-1,3-dione, 8-(2-ethoxyphenyl)-3-isobutyl-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, 8-(2-ethoxyphenyl)-1,7-dimethyl-3-(2-methylpropyl)-1,3,5-trihydro-4-imidazolin o[1,2-h]purine-2,4-dione
| Molecular Formula | C21H25N5O3 |
|---|---|
| Molecular Weight | 395.20 g/mol |
| LogP | 2.50172 |
| Topological Polar Surface Area | 75.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.19574 |
| Heavy Atoms | 29 |
| Complexity | 1336.593 |
Chemical Identifiers
| CAS Number | 904371-97-7 |
|---|---|
| SMILES | CCOC1=CC=CC=C1N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)CC(C)C)C |
Product Overview
VU0509539-1 (CAS 904371-97-7), with molecular formula C21H25N5O3 and molecular weight 395.20 g/mol. IUPAC: 6-(2-ethoxyphenyl)-4,7-dimethyl-2-(2-methylpropyl)purino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of VU0509539-1
Property Insights of VU0509539-1
The XLogP value of 2.50172 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0509539-1. The TPSA of 75.46 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0509539-1. Following Lipinski's Rule of Five, VU0509539-1 has 0 hydrogen bond donor(s) and 4 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 VU0509539-1?
The CAS number of VU0509539-1 is 904371-97-7.
What is the molecular formula of VU0509539-1?
The molecular formula of VU0509539-1 is C21H25N5O3.
What is the molecular weight of VU0509539-1?
The molecular weight of VU0509539-1 is 395.20 g/mol.
Where can I buy VU0509539-1?
You can request a quote for VU0509539-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0509539-1?
Yes, KEHONG BIO provides custom synthesis services for VU0509539-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.