VU0489877-1
TL;DR: VU0489877-1 (CAS 873076-77-8) is a chemical compound with molecular formula C17H17ClN6O3 and molecular weight 388.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[9-(4-chlorophenyl)-1-methyl-2,4-dioxo-7,8-dihydro-6H-purino[7,8-a]pyrimidin-3-yl]acetamide
Also Known As: VU0489877-1, AB00677737-01, F2013-0200, 2-[9-(4-chlorophenyl)-1-methyl-2,4-dioxo-7,8-dihydro-6H-purino[7,8-a]pyrimidin-3-yl]acetamide, 2-(9-(4-chlorophenyl)-1-methyl-2,4-dioxo-1,2,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(4H)-yl)acetamide
| Molecular Formula | C17H17ClN6O3 |
|---|---|
| Molecular Weight | 388.11 g/mol |
| LogP | 0.5772 |
| Topological Polar Surface Area | 108.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 388.10507 |
| Heavy Atoms | 27 |
| Complexity | 1174.5725 |
Chemical Identifiers
| CAS Number | 873076-77-8 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)CC(=O)N)N3CCCN(C3=N2)C4=CC=C(C=C4)Cl |
Product Overview
VU0489877-1 (CAS 873076-77-8), with molecular formula C17H17ClN6O3 and molecular weight 388.11 g/mol. IUPAC: 2-[9-(4-chlorophenyl)-1-methyl-2,4-dioxo-7,8-dihydro-6H-purino[7,8-a]pyrimidin-3-yl]acetamide.
Chemical Property Profile of VU0489877-1
Property Insights of VU0489877-1
The XLogP value of 0.5772 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0489877-1. The TPSA of 108.15 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0489877-1. Following Lipinski's Rule of Five, VU0489877-1 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 VU0489877-1?
The CAS number of VU0489877-1 is 873076-77-8.
What is the molecular formula of VU0489877-1?
The molecular formula of VU0489877-1 is C17H17ClN6O3.
What is the molecular weight of VU0489877-1?
The molecular weight of VU0489877-1 is 388.11 g/mol.
Where can I buy VU0489877-1?
You can request a quote for VU0489877-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0489877-1?
Yes, KEHONG BIO provides custom synthesis services for VU0489877-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.