N2-Methyl-1,N2-isopropenoacyclovir
TL;DR: N2-Methyl-1,N2-isopropenoacyclovir (CAS 114199-20-1) 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)-5,6-dimethylimidazo[1,2-a]purin-9-one
Also Known As: N2-Methyl-1,N2-isopropenoacyclovir, N2-Methyl-1, N2-isopropenoacyclovir, 3-(2-hydroxyethoxymethyl)-5,6-dimethylimidazo[1,2-a]purin-9-one, N2-Methyl-1,N2-isopropeno-9-((2-hydroxyethoxy)methyl)guanine, 9H-Imidazo(1,2-a)purin-9-one, 3,5-dihydro-3-((2-hydroxyethoxy)methyl)-5,6-dimethyl-
Technical Specifications
| Molecular Formula | C12H15N5O3 |
| Molecular Weight | 277.1175 g/mol |
| XLogP | -1.0 |
| Topological Polar Surface Area (TPSA) | 83.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 277.1175 Da |
| Heavy Atoms | 20 |
| Complexity | 478.0 |
| SMILES | CC1=CN2C(=O)C3=C(N=C2N1C)N(C=N3)COCCO |
| InChIKey | LAQPSUWVPAAKQD-UHFFFAOYSA-N |
Chemical Property Profile of N2-Methyl-1,N2-isopropenoacyclovir
Property Insights of N2-Methyl-1,N2-isopropenoacyclovir
The XLogP value of -1.0 indicates that N2-Methyl-1,N2-isopropenoacyclovir is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N2-Methyl-1,N2-isopropenoacyclovir. Following Lipinski's Rule of Five, N2-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 N2-Methyl-1,N2-isopropenoacyclovir?
The CAS number of N2-Methyl-1,N2-isopropenoacyclovir is 114199-20-1.
What is the molecular formula of N2-Methyl-1,N2-isopropenoacyclovir?
The molecular formula of N2-Methyl-1,N2-isopropenoacyclovir is C12H15N5O3.
What is the molecular weight of N2-Methyl-1,N2-isopropenoacyclovir?
The molecular weight of N2-Methyl-1,N2-isopropenoacyclovir is 277.1175 g/mol.
Where can I buy N2-Methyl-1,N2-isopropenoacyclovir?
You can request a quote for N2-Methyl-1,N2-isopropenoacyclovir directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N2-Methyl-1,N2-isopropenoacyclovir?
Yes, CoreyChem provides custom synthesis services for N2-Methyl-1,N2-isopropenoacyclovir and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.