1,3-Dimethyl-8-(4-morpholinyl)-7-(2-oxo-2-PH-ET)-3,7-dihydro-1H-purine-2,6-dione
TL;DR: 1,3-Dimethyl-8-(4-morpholinyl)-7-(2-oxo-2-PH-ET)-3,7-dihydro-1H-purine-2,6-dione (CAS 111442-55-8) is a chemical compound with molecular formula C19H21N5O4 and molecular weight 383.15936 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3-dimethyl-8-morpholin-4-yl-7-phenacylpurine-2,6-dione
Also Known As: BAS 06502947, VU0286007-2, 1,3-dimethyl-8-morpholin-4-yl-7-phenacylpurine-2,6-dione, 1,3-dimethyl-8-morpholino-7-(2-oxo-2-phenylethyl)-1H-purine-2,6(3H,7H)-dione, 7-phenacyl-8-N-morpholino-1,3-dimethylxanthine
Technical Specifications
| Molecular Formula | C19H21N5O4 |
| Molecular Weight | 383.15936 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 88.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.15936 Da |
| Heavy Atoms | 28 |
| Complexity | 632.0 |
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCOCC3)CC(=O)C4=CC=CC=C4 |
| InChIKey | PHONRONVRAWODB-UHFFFAOYSA-N |
Chemical Property Profile of 1,3-Dimethyl-8-(4-morpholinyl)-7-(2-oxo-2-PH-ET)-3,7-dihydro-1H-purine-2,6-dione
Property Insights of 1,3-Dimethyl-8-(4-morpholinyl)-7-(2-oxo-2-PH-ET)-3,7-dihydro-1H-purine-2,6-dione
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dimethyl-8-(4-morpholinyl)-7-(2-oxo-2-PH-ET)-3,7-dihydro-1H-purine-2,6-dione. The TPSA of 88.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dimethyl-8-(4-morpholinyl)-7-(2-oxo-2-PH-ET)-3,7-dihydro-1H-purine-2,6-dione. Following Lipinski's Rule of Five, 1,3-Dimethyl-8-(4-morpholinyl)-7-(2-oxo-2-PH-ET)-3,7-dihydro-1H-purine-2,6-dione has 0 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 1,3-Dimethyl-8-(4-morpholinyl)-7-(2-oxo-2-PH-ET)-3,7-dihydro-1H-purine-2,6-dione?
The CAS number of 1,3-Dimethyl-8-(4-morpholinyl)-7-(2-oxo-2-PH-ET)-3,7-dihydro-1H-purine-2,6-dione is 111442-55-8.
What is the molecular formula of 1,3-Dimethyl-8-(4-morpholinyl)-7-(2-oxo-2-PH-ET)-3,7-dihydro-1H-purine-2,6-dione?
The molecular formula of 1,3-Dimethyl-8-(4-morpholinyl)-7-(2-oxo-2-PH-ET)-3,7-dihydro-1H-purine-2,6-dione is C19H21N5O4.
What is the molecular weight of 1,3-Dimethyl-8-(4-morpholinyl)-7-(2-oxo-2-PH-ET)-3,7-dihydro-1H-purine-2,6-dione?
The molecular weight of 1,3-Dimethyl-8-(4-morpholinyl)-7-(2-oxo-2-PH-ET)-3,7-dihydro-1H-purine-2,6-dione is 383.15936 g/mol.
Where can I buy 1,3-Dimethyl-8-(4-morpholinyl)-7-(2-oxo-2-PH-ET)-3,7-dihydro-1H-purine-2,6-dione?
You can request a quote for 1,3-Dimethyl-8-(4-morpholinyl)-7-(2-oxo-2-PH-ET)-3,7-dihydro-1H-purine-2,6-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-Dimethyl-8-(4-morpholinyl)-7-(2-oxo-2-PH-ET)-3,7-dihydro-1H-purine-2,6-dione?
Yes, CoreyChem provides custom synthesis services for 1,3-Dimethyl-8-(4-morpholinyl)-7-(2-oxo-2-PH-ET)-3,7-dihydro-1H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.