Tetrahydro-5,7-dimethyl-1H-imidazo[4,5-e]-1,2,4-triazine-3,6(2H,4H)-dione
TL;DR: Tetrahydro-5,7-dimethyl-1H-imidazo[4,5-e]-1,2,4-triazine-3,6(2H,4H)-dione (CAS 498530-46-4) is a chemical compound with molecular formula C6H11N5O2 and molecular weight 185.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dimethyl-2,4,4a,7a-tetrahydro-1H-imidazo[4,5-e][1,2,4]triazine-3,6-dione
Also Known As: ChemDiv1_026340, 5,7-dimethyltetrahydro-1H-imidazo[4,5-e][1,2,4]triazine-3,6(2H,4H)-dione, A2253/0094928, 7,9-dimethyl-1,3,4,5,6,7-hexahydro-6-azapurine-2,8-dione, Tetrahydro-5,7-dimethyl-1H-imidazo[4,5-e]-1,2,4-triazine-3,6(2H,4H)-dione
| Molecular Formula | C6H11N5O2 |
|---|---|
| Molecular Weight | 185.09 g/mol |
| LogP | -1.5468 |
| Topological Polar Surface Area | 76.71 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 185.09128 |
| Heavy Atoms | 13 |
| Complexity | 267.7502 |
Chemical Identifiers
| CAS Number | 498530-46-4 |
|---|---|
| SMILES | CN1C2C(NNC(=O)N2)N(C1=O)C |
Product Overview
Tetrahydro-5,7-dimethyl-1H-imidazo[4,5-e]-1,2,4-triazine-3,6(2H,4H)-dione (CAS 498530-46-4), with molecular formula C6H11N5O2 and molecular weight 185.09 g/mol. IUPAC: 5,7-dimethyl-2,4,4a,7a-tetrahydro-1H-imidazo[4,5-e][1,2,4]triazine-3,6-dione.
Chemical Property Profile of Tetrahydro-5,7-dimethyl-1H-imidazo[4,5-e]-1,2,4-triazine-3,6(2H,4H)-dione
Property Insights of Tetrahydro-5,7-dimethyl-1H-imidazo[4,5-e]-1,2,4-triazine-3,6(2H,4H)-dione
The XLogP value of -1.5468 indicates that Tetrahydro-5,7-dimethyl-1H-imidazo[4,5-e]-1,2,4-triazine-3,6(2H,4H)-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 76.71 Ų falls within the moderate polarity range, balancing permeability and solubility for Tetrahydro-5,7-dimethyl-1H-imidazo[4,5-e]-1,2,4-triazine-3,6(2H,4H)-dione. Following Lipinski's Rule of Five, Tetrahydro-5,7-dimethyl-1H-imidazo[4,5-e]-1,2,4-triazine-3,6(2H,4H)-dione has 3 hydrogen bond donor(s) and 3 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 Tetrahydro-5,7-dimethyl-1H-imidazo[4,5-e]-1,2,4-triazine-3,6(2H,4H)-dione?
The CAS number of Tetrahydro-5,7-dimethyl-1H-imidazo[4,5-e]-1,2,4-triazine-3,6(2H,4H)-dione is 498530-46-4.
What is the molecular formula of Tetrahydro-5,7-dimethyl-1H-imidazo[4,5-e]-1,2,4-triazine-3,6(2H,4H)-dione?
The molecular formula of Tetrahydro-5,7-dimethyl-1H-imidazo[4,5-e]-1,2,4-triazine-3,6(2H,4H)-dione is C6H11N5O2.
What is the molecular weight of Tetrahydro-5,7-dimethyl-1H-imidazo[4,5-e]-1,2,4-triazine-3,6(2H,4H)-dione?
The molecular weight of Tetrahydro-5,7-dimethyl-1H-imidazo[4,5-e]-1,2,4-triazine-3,6(2H,4H)-dione is 185.09 g/mol.
Where can I buy Tetrahydro-5,7-dimethyl-1H-imidazo[4,5-e]-1,2,4-triazine-3,6(2H,4H)-dione?
You can request a quote for Tetrahydro-5,7-dimethyl-1H-imidazo[4,5-e]-1,2,4-triazine-3,6(2H,4H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrahydro-5,7-dimethyl-1H-imidazo[4,5-e]-1,2,4-triazine-3,6(2H,4H)-dione?
Yes, KEHONG BIO provides custom synthesis services for Tetrahydro-5,7-dimethyl-1H-imidazo[4,5-e]-1,2,4-triazine-3,6(2H,4H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.