TL;DR: Ethyl 4-(2,6-dimethylanilino)-2-methylpyrimidine-5-carboxylate (CAS 132448-84-1) is a chemical compound with molecular formula C16H19N3O2 and molecular weight 285.14774 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 4-(2,6-dimethylanilino)-2-methylpyrimidine-5-carboxylate
Also Known As: ethyl 4-(2,6-dimethylanilino)-2-methylpyrimidine-5-carboxylate
| Molecular Formula | C16H19N3O2 |
| Molecular Weight | 285.14774 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 64.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 285.14774 Da |
| Heavy Atoms | 21 |
| Complexity | 340.0 |
| SMILES | CCOC(=O)C1=CN=C(N=C1NC2=C(C=CC=C2C)C)C |
| InChIKey | PPHYCEWARKXNRD-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that Ethyl 4-(2,6-dimethylanilino)-2-methylpyrimidine-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-(2,6-dimethylanilino)-2-methylpyrimidine-5-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-(2,6-dimethylanilino)-2-methylpyrimidine-5-carboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ethyl 4-(2,6-dimethylanilino)-2-methylpyrimidine-5-carboxylate is 132448-84-1.
The molecular formula of Ethyl 4-(2,6-dimethylanilino)-2-methylpyrimidine-5-carboxylate is C16H19N3O2.
The molecular weight of Ethyl 4-(2,6-dimethylanilino)-2-methylpyrimidine-5-carboxylate is 285.14774 g/mol.
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