VU0606592-1
TL;DR: VU0606592-1 (CAS 896828-01-6) is a chemical compound with molecular formula C20H21N5O5 and molecular weight 411.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[6-(3-methoxyphenyl)-4,7,8-trimethyl-1,3-dioxopurino[7,8-a]imidazol-2-yl]acetate
Also Known As: VU0606592-1, F3235-0014, methyl 2-[6-(3-methoxyphenyl)-4,7,8-trimethyl-1,3-dioxopurino[7,8-a]imidazol-2-yl]acetate, methyl [8-(3-methoxyphenyl)-1,6,7-trimethyl-2,4-dioxo-1,2,4,8-tetrahydro-3H-imidazo[2,1-f]purin-3-yl]acetate, methyl 2-(8-(3-methoxyphenyl)-1,6,7-trimethyl-2,4-dioxo-1H-imidazo[2,1-f]purin-3(2H,4H,8H)-yl)acetate
| Molecular Formula | C20H21N5O5 |
|---|---|
| Molecular Weight | 411.15 g/mol |
| LogP | 0.93704 |
| Topological Polar Surface Area | 101.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 411.15427 |
| Heavy Atoms | 30 |
| Complexity | 1436.3164 |
Chemical Identifiers
| CAS Number | 896828-01-6 |
|---|---|
| SMILES | CC1=C(N2C3=C(N=C2N1C4=CC(=CC=C4)OC)N(C(=O)N(C3=O)CC(=O)OC)C)C |
Product Overview
VU0606592-1 (CAS 896828-01-6), with molecular formula C20H21N5O5 and molecular weight 411.15 g/mol. IUPAC: methyl 2-[6-(3-methoxyphenyl)-4,7,8-trimethyl-1,3-dioxopurino[7,8-a]imidazol-2-yl]acetate.
Chemical Property Profile of VU0606592-1
Property Insights of VU0606592-1
The XLogP value of 0.93704 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0606592-1. The TPSA of 101.76 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0606592-1. Following Lipinski's Rule of Five, VU0606592-1 has 0 hydrogen bond donor(s) and 6 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 VU0606592-1?
The CAS number of VU0606592-1 is 896828-01-6.
What is the molecular formula of VU0606592-1?
The molecular formula of VU0606592-1 is C20H21N5O5.
What is the molecular weight of VU0606592-1?
The molecular weight of VU0606592-1 is 411.15 g/mol.
Where can I buy VU0606592-1?
You can request a quote for VU0606592-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0606592-1?
Yes, KEHONG BIO provides custom synthesis services for VU0606592-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.