4a-Hydroxy-6,8-dimethyl-2,8-dihydro-4ah-pyrimido[5,4-E][1,2,4]triazine-5,7-dione
TL;DR: 4a-Hydroxy-6,8-dimethyl-2,8-dihydro-4ah-pyrimido[5,4-E][1,2,4]triazine-5,7-dione (CAS 439127-30-7) is a chemical compound with molecular formula C7H9N5O3 and molecular weight 211.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4a-hydroxy-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione
Also Known As: 4a-hydroxy-6,8-dimethyl-6,8-dihydropyrimido[5,4-e][1,2,4]triazine-5,7(2H,4aH)-dione, 4a-hydroxy-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione, 4a-Hydroxy-6,8-dimethyl-2,8-dihydro-4ah-pyrimido[5,4-E][1,2,4]triazine-5,7-dione, 4a-hydroxy-6,8-dimethyl-4,8-dihydropyrimido[5,4-e][1,2,4]triazine-5,7(4aH,6H)-dione
| Molecular Formula | C7H9N5O3 |
|---|---|
| Molecular Weight | 211.07 g/mol |
| LogP | -1.8562 |
| Topological Polar Surface Area | 97.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 211.07054 |
| Heavy Atoms | 15 |
| Complexity | 403.42984 |
Chemical Identifiers
| CAS Number | 439127-30-7 |
|---|---|
| SMILES | CN1C2=NNC=NC2(C(=O)N(C1=O)C)O |
Product Overview
4a-Hydroxy-6,8-dimethyl-2,8-dihydro-4ah-pyrimido[5,4-E][1,2,4]triazine-5,7-dione (CAS 439127-30-7), with molecular formula C7H9N5O3 and molecular weight 211.07 g/mol. IUPAC: 4a-hydroxy-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione.
Chemical Property Profile of 4a-Hydroxy-6,8-dimethyl-2,8-dihydro-4ah-pyrimido[5,4-E][1,2,4]triazine-5,7-dione
Property Insights of 4a-Hydroxy-6,8-dimethyl-2,8-dihydro-4ah-pyrimido[5,4-E][1,2,4]triazine-5,7-dione
The XLogP value of -1.8562 indicates that 4a-Hydroxy-6,8-dimethyl-2,8-dihydro-4ah-pyrimido[5,4-E][1,2,4]triazine-5,7-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 97.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4a-Hydroxy-6,8-dimethyl-2,8-dihydro-4ah-pyrimido[5,4-E][1,2,4]triazine-5,7-dione. Following Lipinski's Rule of Five, 4a-Hydroxy-6,8-dimethyl-2,8-dihydro-4ah-pyrimido[5,4-E][1,2,4]triazine-5,7-dione has 2 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 4a-Hydroxy-6,8-dimethyl-2,8-dihydro-4ah-pyrimido[5,4-E][1,2,4]triazine-5,7-dione?
The CAS number of 4a-Hydroxy-6,8-dimethyl-2,8-dihydro-4ah-pyrimido[5,4-E][1,2,4]triazine-5,7-dione is 439127-30-7.
What is the molecular formula of 4a-Hydroxy-6,8-dimethyl-2,8-dihydro-4ah-pyrimido[5,4-E][1,2,4]triazine-5,7-dione?
The molecular formula of 4a-Hydroxy-6,8-dimethyl-2,8-dihydro-4ah-pyrimido[5,4-E][1,2,4]triazine-5,7-dione is C7H9N5O3.
What is the molecular weight of 4a-Hydroxy-6,8-dimethyl-2,8-dihydro-4ah-pyrimido[5,4-E][1,2,4]triazine-5,7-dione?
The molecular weight of 4a-Hydroxy-6,8-dimethyl-2,8-dihydro-4ah-pyrimido[5,4-E][1,2,4]triazine-5,7-dione is 211.07 g/mol.
Where can I buy 4a-Hydroxy-6,8-dimethyl-2,8-dihydro-4ah-pyrimido[5,4-E][1,2,4]triazine-5,7-dione?
You can request a quote for 4a-Hydroxy-6,8-dimethyl-2,8-dihydro-4ah-pyrimido[5,4-E][1,2,4]triazine-5,7-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4a-Hydroxy-6,8-dimethyl-2,8-dihydro-4ah-pyrimido[5,4-E][1,2,4]triazine-5,7-dione?
Yes, KEHONG BIO provides custom synthesis services for 4a-Hydroxy-6,8-dimethyl-2,8-dihydro-4ah-pyrimido[5,4-E][1,2,4]triazine-5,7-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.