7-ethyl-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
TL;DR: 7-ethyl-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione (CAS 114145-19-6) is a chemical compound with molecular formula C12H17N5O3 and molecular weight 279.13315 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-ethyl-3-methyl-8-morpholin-4-ylpurine-2,6-dione
Also Known As: BAS 00286806, 7-ethyl-3-methyl-8-morpholin-4-ylpurine-2,6-dione, 7-ethyl-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione, 7-Ethyl-3-methyl-8-morpholin-4-yl-3,7-dihydro-purine-2,6-dione
Technical Specifications
| Molecular Formula | C12H17N5O3 |
| Molecular Weight | 279.13315 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 79.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 279.13315 Da |
| Heavy Atoms | 20 |
| Complexity | 412.0 |
| SMILES | CCN1C2=C(N=C1N3CCOCC3)N(C(=O)NC2=O)C |
| InChIKey | JSOBCAWFIVKGQO-UHFFFAOYSA-N |
Chemical Property Profile of 7-ethyl-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
Property Insights of 7-ethyl-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
The XLogP value of -0.2 indicates that 7-ethyl-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 79.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-ethyl-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione. Following Lipinski's Rule of Five, 7-ethyl-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione 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-ethyl-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione?
The CAS number of 7-ethyl-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione is 114145-19-6.
What is the molecular formula of 7-ethyl-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione?
The molecular formula of 7-ethyl-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione is C12H17N5O3.
What is the molecular weight of 7-ethyl-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione?
The molecular weight of 7-ethyl-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione is 279.13315 g/mol.
Where can I buy 7-ethyl-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione?
You can request a quote for 7-ethyl-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 7-ethyl-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione?
Yes, CoreyChem provides custom synthesis services for 7-ethyl-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.