TL;DR: 4(1H)-Pyrimidinone, 5-(4-morpholinyl)- (CAS 153004-48-9) is a chemical compound with molecular formula C8H11N3O2 and molecular weight 181.08513 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-morpholin-4-yl-1H-pyrimidin-6-one
Also Known As: 5-(4-Morpholinyl)-4(1H)-pyrimidinone, 4(1H)-Pyrimidinone, 5-(4-morpholinyl)-, 5-morpholin-4-yl-1H-pyrimidin-6-one, 5-(Morpholin-4-yl)pyrimidin-4(3H)-one
| Molecular Formula | C8H11N3O2 |
| Molecular Weight | 181.08513 g/mol |
| XLogP | -0.8 |
| Topological Polar Surface Area (TPSA) | 53.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 181.08513 Da |
| Heavy Atoms | 13 |
| Complexity | 267.0 |
| SMILES | C1COCCN1C2=CN=CNC2=O |
| InChIKey | SWJMXJLFSMWVJZ-UHFFFAOYSA-N |
The XLogP value of -0.8 indicates that 4(1H)-Pyrimidinone, 5-(4-morpholinyl)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 53.9 Ų, 4(1H)-Pyrimidinone, 5-(4-morpholinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4(1H)-Pyrimidinone, 5-(4-morpholinyl)- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4(1H)-Pyrimidinone, 5-(4-morpholinyl)- is 153004-48-9.
The molecular formula of 4(1H)-Pyrimidinone, 5-(4-morpholinyl)- is C8H11N3O2.
The molecular weight of 4(1H)-Pyrimidinone, 5-(4-morpholinyl)- is 181.08513 g/mol.
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