TL;DR: BAS 00444387 (CAS 144294-63-3) is a chemical compound with molecular formula C16H20N4O4 and molecular weight 332.14847 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-[[(E)-(3,4-dimethoxyphenyl)methylideneamino]-ethylamino]-3-methyl-1H-pyrimidine-2,4-dione
Also Known As: BAS 00444387, 6-[(2E)-2-(3,4-dimethoxybenzylidene)-1-ethylhydrazinyl]-3-methylpyrimidine-2,4(1H,3H)-dione, (E)-6-(2-(3,4-dimethoxybenzylidene)-1-ethylhydrazinyl)-3-methylpyrimidine-2,4(1H,3H)-dione, 6-[(2E)-2-(3,4-dimethoxybenzylidene)-1-ethylhydrazinyl]-2-hydroxy-3-methylpyrimidin-4(3H)-one, 6-{[(1E)-2-(3,4-dimethoxyphenyl)-1-azavinyl]ethylamino}-3-methyl-1,3-dihydropy rimidine-2,4-dione
| Molecular Formula | C16H20N4O4 |
| Molecular Weight | 332.14847 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 83.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 332.14847 Da |
| Heavy Atoms | 24 |
| Complexity | 534.0 |
| SMILES | CCN(C1=CC(=O)N(C(=O)N1)C)/N=C/C2=CC(=C(C=C2)OC)OC |
| InChIKey | FUDYRPMQANAXLU-LICLKQGHSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00444387. The TPSA of 83.5 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00444387. Following Lipinski's Rule of Five, BAS 00444387 has 1 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 BAS 00444387 is 144294-63-3.
The molecular formula of BAS 00444387 is C16H20N4O4.
The molecular weight of BAS 00444387 is 332.14847 g/mol.
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