1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione
TL;DR: 1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione (CAS 1632-29-7) is a chemical compound with molecular formula C6H7N5O2 and molecular weight 181.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dimethyltriazolo[4,5-d]pyrimidine-5,7-dione
Also Known As: 3,7-Dimethyl-8-azaxanthin, 3,7-dimethyl-8-azaxanthine, 1,4-dimethyltriazolo[4,5-d]pyrimidine-5,7-dione, KST-1B0883, 1,5-d]pyrimidine-5,7(4H,6H)-dione
| Molecular Formula | C6H7N5O2 |
|---|---|
| Molecular Weight | 181.06 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 80.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 181.05997 |
| Heavy Atoms | 13 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 1632-29-7 |
|---|---|
| SMILES | CN1C2=C(N=N1)N(C(=O)NC2=O)C |
| InChIKey | UFLYXBDGSAGNAR-UHFFFAOYSA-N |
Product Overview
1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione (CAS 1632-29-7), with molecular formula C6H7N5O2 and molecular weight 181.06 g/mol. IUPAC: 1,4-dimethyltriazolo[4,5-d]pyrimidine-5,7-dione.
Chemical Property Profile of 1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione
Property Insights of 1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione
The XLogP value of -0.9 indicates that 1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 80.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione. Following Lipinski's Rule of Five, 1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione has 1 hydrogen bond donor(s) and 4 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 1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione?
The CAS number of 1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione is 1632-29-7.
What is the molecular formula of 1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione?
The molecular formula of 1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione is C6H7N5O2.
What is the molecular weight of 1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione?
The molecular weight of 1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione is 181.06 g/mol.
Where can I buy 1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione?
You can request a quote for 1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.