VU0492972-1
TL;DR: VU0492972-1 (CAS 847035-67-0) is a chemical compound with molecular formula C18H20N6O3 and molecular weight 368.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-methyl-9-(3-methylphenyl)-2,4-dioxo-7,8-dihydro-6H-purino[7,8-a]pyrimidin-3-yl]acetamide
Also Known As: VU0492972-1, 2-(1-methyl-2,4-dioxo-9-(m-tolyl)-1,2,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(4H)-yl)acetamide, F3235-0529, 2-[1-methyl-9-(3-methylphenyl)-2,4-dioxo-7,8-dihydro-6H-purino[7,8-a]pyrimidin-3-yl]acetamide, 2-[1-methyl-9-(3-methylphenyl)-2,4-dioxo-1,3,5-trihydro-6H,7H,8H-1,3-diazaperh ydroino[1,2-h]purin-3-yl]acetamide
| Molecular Formula | C18H20N6O3 |
|---|---|
| Molecular Weight | 368.16 g/mol |
| LogP | 0.23222 |
| Topological Polar Surface Area | 108.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 368.1597 |
| Heavy Atoms | 27 |
| Complexity | 1186.2507 |
Chemical Identifiers
| CAS Number | 847035-67-0 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2CCCN3C2=NC4=C3C(=O)N(C(=O)N4C)CC(=O)N |
Product Overview
VU0492972-1 (CAS 847035-67-0), with molecular formula C18H20N6O3 and molecular weight 368.16 g/mol. IUPAC: 2-[1-methyl-9-(3-methylphenyl)-2,4-dioxo-7,8-dihydro-6H-purino[7,8-a]pyrimidin-3-yl]acetamide.
Chemical Property Profile of VU0492972-1
Property Insights of VU0492972-1
The XLogP value of 0.23222 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0492972-1. The TPSA of 108.15 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0492972-1. Following Lipinski's Rule of Five, VU0492972-1 has 1 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 VU0492972-1?
The CAS number of VU0492972-1 is 847035-67-0.
What is the molecular formula of VU0492972-1?
The molecular formula of VU0492972-1 is C18H20N6O3.
What is the molecular weight of VU0492972-1?
The molecular weight of VU0492972-1 is 368.16 g/mol.
Where can I buy VU0492972-1?
You can request a quote for VU0492972-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0492972-1?
Yes, KEHONG BIO provides custom synthesis services for VU0492972-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.