A2162/0090812
TL;DR: A2162/0090812 (CAS 309289-94-9) is a chemical compound with molecular formula C17H18N6O3 and molecular weight 354.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-hydroxyethyl)-7,9-dimethyl-3-phenyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione
Also Known As: A2162/0090812, 1-(2-hydroxyethyl)-7,9-dimethyl-3-phenyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione, 1-(2-hydroxyethyl)-7,9-dimethyl-3-phenyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione, 1-(2-HYDROXYETHYL)-7,9-DIMETHYL-3-PHENYL-1H,4H,6H,7H,8H,9H-[1,2,4]TRIAZINO[4,3-G]PURINE-6,8-DIONE, 1-(2-hydroxyethyl)-7,9-dimethyl-3-phenyl-7,9-dihydro-[1,2,4]triazino[3,4-f]purine-6,8(1H,4H)-dione
| Molecular Formula | C17H18N6O3 |
|---|---|
| Molecular Weight | 354.14 g/mol |
| LogP | -0.3497 |
| Topological Polar Surface Area | 97.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 354.14404 |
| Heavy Atoms | 26 |
| Complexity | 1139.2451 |
Chemical Identifiers
| CAS Number | 309289-94-9 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N3CC(=NN(C3=N2)CCO)C4=CC=CC=C4 |
Product Overview
A2162/0090812 (CAS 309289-94-9), with molecular formula C17H18N6O3 and molecular weight 354.14 g/mol. IUPAC: 1-(2-hydroxyethyl)-7,9-dimethyl-3-phenyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione.
Chemical Property Profile of A2162/0090812
Property Insights of A2162/0090812
The XLogP value of -0.3497 indicates that A2162/0090812 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 97.65 Ų falls within the moderate polarity range, balancing permeability and solubility for A2162/0090812. Following Lipinski's Rule of Five, A2162/0090812 has 1 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 A2162/0090812?
The CAS number of A2162/0090812 is 309289-94-9.
What is the molecular formula of A2162/0090812?
The molecular formula of A2162/0090812 is C17H18N6O3.
What is the molecular weight of A2162/0090812?
The molecular weight of A2162/0090812 is 354.14 g/mol.
Where can I buy A2162/0090812?
You can request a quote for A2162/0090812 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2162/0090812?
Yes, KEHONG BIO provides custom synthesis services for A2162/0090812 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.