VU0492622-1
TL;DR: VU0492622-1 (CAS 164410-91-7) is a chemical compound with molecular formula C17H17N5O4 and molecular weight 355.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-methyl-2,4-dioxo-9-phenyl-7,8-dihydro-6H-purino[7,8-a]pyrimidin-3-yl)acetic acid
Also Known As: VU0492622-1, AB00689160-01, 2-(1-methyl-2,4-dioxo-9-phenyl-1,2,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(4H)-yl)acetic acid, 2-(1-methyl-2,4-dioxo-9-phenyl-7,8-dihydro-6H-purino[7,8-a]pyrimidin-3-yl)acetic acid, F3124-1180
| Molecular Formula | C17H17N5O4 |
|---|---|
| Molecular Weight | 355.13 g/mol |
| LogP | 0.5231 |
| Topological Polar Surface Area | 102.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 355.12805 |
| Heavy Atoms | 26 |
| Complexity | 1125.9912 |
Chemical Identifiers
| CAS Number | 164410-91-7 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)CC(=O)O)N3CCCN(C3=N2)C4=CC=CC=C4 |
Product Overview
VU0492622-1 (CAS 164410-91-7), with molecular formula C17H17N5O4 and molecular weight 355.13 g/mol. IUPAC: 2-(1-methyl-2,4-dioxo-9-phenyl-7,8-dihydro-6H-purino[7,8-a]pyrimidin-3-yl)acetic acid.
Chemical Property Profile of VU0492622-1
Property Insights of VU0492622-1
The XLogP value of 0.5231 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0492622-1. The TPSA of 102.36 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0492622-1. Following Lipinski's Rule of Five, VU0492622-1 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 VU0492622-1?
The CAS number of VU0492622-1 is 164410-91-7.
What is the molecular formula of VU0492622-1?
The molecular formula of VU0492622-1 is C17H17N5O4.
What is the molecular weight of VU0492622-1?
The molecular weight of VU0492622-1 is 355.13 g/mol.
Where can I buy VU0492622-1?
You can request a quote for VU0492622-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0492622-1?
Yes, KEHONG BIO provides custom synthesis services for VU0492622-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.