![2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione structure](/static/products/2130/21308-86-1.webp)
2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione
TL;DR: 2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione (CAS 21308-86-1) is a chemical compound with molecular formula C5H5N5S and molecular weight 167.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione
Also Known As: 2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione, 2,8-Dihydropyrimido[5,4-e][1,2,4]triazine-5(1H)-thione
| Molecular Formula | C5H5N5S |
|---|---|
| Molecular Weight | 167.03 g/mol |
| LogP | 0.72909 |
| Topological Polar Surface Area | 65.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 167.02657 |
| Heavy Atoms | 11 |
| Complexity | 354.13556 |
Chemical Identifiers
| CAS Number | 21308-86-1 |
|---|---|
| SMILES | C1=NC(=S)C2=C(N1)NNC=N2 |
Product Overview
2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione (CAS 21308-86-1), with molecular formula C5H5N5S and molecular weight 167.03 g/mol. IUPAC: 2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione.
Chemical Property Profile of 2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione
Property Insights of 2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione
The XLogP value of 0.72909 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione. The TPSA of 65.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione. Following Lipinski's Rule of Five, 2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione has 3 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 2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione?
The CAS number of 2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione is 21308-86-1.
What is the molecular formula of 2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione?
The molecular formula of 2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione is C5H5N5S.
What is the molecular weight of 2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione?
The molecular weight of 2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione is 167.03 g/mol.
Where can I buy 2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione?
You can request a quote for 2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione?
Yes, KEHONG BIO provides custom synthesis services for 2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.