TL;DR: 5-[(3-diethylaminopropylamino)methylidene]-1-(3-methoxyphenyl)-1,3-diazinane-2,4,6-trione (CAS 578762-48-8) is a chemical compound with molecular formula C19H26N4O4 and molecular weight 374.1954 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[3-(diethylamino)propyliminomethyl]-6-hydroxy-1-(3-methoxyphenyl)pyrimidine-2,4-dione
Also Known As: 5-[(3-diethylaminopropylamino)methylidene]-1-(3-methoxyphenyl)-1,3-diazinane-2,4,6-trione, (5E)-5-[[3-(diethylamino)propylamino]methylidene]-1-(3-methoxyphenyl)-1,3-diazinane-2,4,6-trione, (E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(3-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione, 5-[[3-(diethylamino)propylamino]methylidene]-1-(3-methoxyphenyl)-1,3-diazinane-2,4,6-trione
| Molecular Formula | C19H26N4O4 |
| Molecular Weight | 374.1954 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 94.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 374.1954 Da |
| Heavy Atoms | 27 |
| Complexity | 586.0 |
| SMILES | CCN(CC)CCCN=CC1=C(N(C(=O)NC1=O)C2=CC(=CC=C2)OC)O |
| InChIKey | MXWYTGRDOYXWFG-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(3-diethylaminopropylamino)methylidene]-1-(3-methoxyphenyl)-1,3-diazinane-2,4,6-trione. The TPSA of 94.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(3-diethylaminopropylamino)methylidene]-1-(3-methoxyphenyl)-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 5-[(3-diethylaminopropylamino)methylidene]-1-(3-methoxyphenyl)-1,3-diazinane-2,4,6-trione has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-[(3-diethylaminopropylamino)methylidene]-1-(3-methoxyphenyl)-1,3-diazinane-2,4,6-trione is 578762-48-8.
The molecular formula of 5-[(3-diethylaminopropylamino)methylidene]-1-(3-methoxyphenyl)-1,3-diazinane-2,4,6-trione is C19H26N4O4.
The molecular weight of 5-[(3-diethylaminopropylamino)methylidene]-1-(3-methoxyphenyl)-1,3-diazinane-2,4,6-trione is 374.1954 g/mol.
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