7-Methyl-1,N2-isopropenoacyclovir
TL;DR: 7-Methyl-1,N2-isopropenoacyclovir (CAS 114199-21-2) is a chemical compound with molecular formula C12H15N5O3 and molecular weight 277.1175 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-hydroxyethoxymethyl)-1,6-dimethylimidazo[1,2-a]purin-3-ium-9-olate
Also Known As: 7-Methyl-1,N2-isopropenoacyclovir, 7-Methyl-1, N2-isopropenoacyclovir, 7-Methyl-1,N2-isopropeno-9-((2-hydroxyethoxy)methyl)guanine, 7-Methyl-1, N2-isopropeno-9-[(2-hydroxyethoxy)methyl]guanine, 3-(2-hydroxyethoxymethyl)-1,6-dimethylimidazo[1,2-a]purin-3-ium-9-olate
Technical Specifications
| Molecular Formula | C12H15N5O3 |
| Molecular Weight | 277.1175 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 91.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 277.1175 Da |
| Heavy Atoms | 20 |
| Complexity | 347.0 |
| SMILES | CC1=CN2C(=C3C(=NC2=N1)[N+](=CN3C)COCCO)[O-] |
| InChIKey | CYOYUUNJZWQANX-UHFFFAOYSA-N |
Chemical Property Profile of 7-Methyl-1,N2-isopropenoacyclovir
Property Insights of 7-Methyl-1,N2-isopropenoacyclovir
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Methyl-1,N2-isopropenoacyclovir. The TPSA of 91.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Methyl-1,N2-isopropenoacyclovir. Following Lipinski's Rule of Five, 7-Methyl-1,N2-isopropenoacyclovir has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 7-Methyl-1,N2-isopropenoacyclovir?
The CAS number of 7-Methyl-1,N2-isopropenoacyclovir is 114199-21-2.
What is the molecular formula of 7-Methyl-1,N2-isopropenoacyclovir?
The molecular formula of 7-Methyl-1,N2-isopropenoacyclovir is C12H15N5O3.
What is the molecular weight of 7-Methyl-1,N2-isopropenoacyclovir?
The molecular weight of 7-Methyl-1,N2-isopropenoacyclovir is 277.1175 g/mol.
Where can I buy 7-Methyl-1,N2-isopropenoacyclovir?
You can request a quote for 7-Methyl-1,N2-isopropenoacyclovir directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 7-Methyl-1,N2-isopropenoacyclovir?
Yes, CoreyChem provides custom synthesis services for 7-Methyl-1,N2-isopropenoacyclovir and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.