TL;DR: Pyrido(2,3-d)pyrimidin-4(3H)-one, 3-(2-(diethylamino)ethyl)-2-methyl- (CAS 101204-95-9) is a chemical compound with molecular formula C14H20N4O and molecular weight 260.1637 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[2-(diethylamino)ethyl]-2-methylpyrido[2,3-d]pyrimidin-4-one
Also Known As: Pyrido(2,3-d)pyrimidin-4(3H)-one, 3-(2-(diethylamino)ethyl)-2-methyl-, 3-(2-(Diethylamino)ethyl)-2-methylpyrido(2,3-d)pyrimidin-4(3H)-one, 3-(2-diethylaminoethyl)-2-methylpyrido[2,3-d]pyrimidin-4-one, 3-[2-(DIETHYLAMINO)ETHYL]-2-METHYLPYRIDO[2,3-D]PYRIMIDIN-4-ONE, 3-(2-diethylamino-ethyl)-2-methyl-3H-pyrido[2,3-d]pyrimidin-4-one
| Molecular Formula | C14H20N4O |
| Molecular Weight | 260.1637 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 48.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 260.1637 Da |
| Heavy Atoms | 19 |
| Complexity | 351.0 |
| SMILES | CCN(CC)CCN1C(=NC2=C(C1=O)C=CC=N2)C |
| InChIKey | ZFKRNMFFVAIAJE-UHFFFAOYSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrido(2,3-d)pyrimidin-4(3H)-one, 3-(2-(diethylamino)ethyl)-2-methyl-. With a topological polar surface area (TPSA) of 48.8 Ų, Pyrido(2,3-d)pyrimidin-4(3H)-one, 3-(2-(diethylamino)ethyl)-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrido(2,3-d)pyrimidin-4(3H)-one, 3-(2-(diethylamino)ethyl)-2-methyl- has 0 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 Pyrido(2,3-d)pyrimidin-4(3H)-one, 3-(2-(diethylamino)ethyl)-2-methyl- is 101204-95-9.
The molecular formula of Pyrido(2,3-d)pyrimidin-4(3H)-one, 3-(2-(diethylamino)ethyl)-2-methyl- is C14H20N4O.
The molecular weight of Pyrido(2,3-d)pyrimidin-4(3H)-one, 3-(2-(diethylamino)ethyl)-2-methyl- is 260.1637 g/mol.
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