RefChem:204155
TL;DR: RefChem:204155 (CAS 105774-53-6) is a chemical compound with molecular formula C14H14N6O2S and molecular weight 330.0899 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-ethyl-9-methyl-3-thiophen-2-yl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione
Also Known As: (1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 1-ethyl-1,4-dihydro-9-methyl-3-(2-thienyl)-, 1-Ethyl-1,4-dihydro-9-methyl-3-(2-thienyl)-(1,2,4)triazino(3,4-f)purine-6,8(7H,9H)-dione, 1-ethyl-9-methyl-3-thiophen-2-yl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione, 1-Ethyl-9-methyl-3-(thiophen-2-yl)-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione, BRN 5648235
Technical Specifications
| Molecular Formula | C14H14N6O2S |
| Molecular Weight | 330.0899 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 111.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 330.0899 Da |
| Heavy Atoms | 23 |
| Complexity | 569.0 |
| SMILES | CCN1C2=NC3=C(N2CC(=N1)C4=CC=CS4)C(=O)NC(=O)N3C |
| InChIKey | JQNIPPNHQORIAS-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:204155
Property Insights of RefChem:204155
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:204155. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:204155. Following Lipinski's Rule of Five, RefChem:204155 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
What is the CAS number of RefChem:204155?
The CAS number of RefChem:204155 is 105774-53-6.
What is the molecular formula of RefChem:204155?
The molecular formula of RefChem:204155 is C14H14N6O2S.
What is the molecular weight of RefChem:204155?
The molecular weight of RefChem:204155 is 330.0899 g/mol.
Where can I buy RefChem:204155?
You can request a quote for RefChem:204155 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:204155?
Yes, CoreyChem provides custom synthesis services for RefChem:204155 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.