Ethyl 2-(benzylamino)-4-methylpyrimidine-5-carboxylate
TL;DR: Ethyl 2-(benzylamino)-4-methylpyrimidine-5-carboxylate (CAS 108123-81-5) is a chemical compound with molecular formula C15H17N3O2 and molecular weight 271.13208 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-(benzylamino)-4-methylpyrimidine-5-carboxylate
Also Known As: ethyl 2-(benzylamino)-4-methylpyrimidine-5-carboxylate, 8448AC, BAS 12290816, ethyl2-(benzylamino)-4-methylpyrimidine-5-carboxylate, 5-Pyrimidinecarboxylic acid, 4-methyl-2-[(phenylmethyl)amino]-, ethyl ester
Technical Specifications
| Molecular Formula | C15H17N3O2 |
| Molecular Weight | 271.13208 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 64.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 271.13208 Da |
| Heavy Atoms | 20 |
| Complexity | 305.0 |
| SMILES | CCOC(=O)C1=CN=C(N=C1C)NCC2=CC=CC=C2 |
| InChIKey | TZBQVZUKPBMPCA-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 2-(benzylamino)-4-methylpyrimidine-5-carboxylate
Property Insights of Ethyl 2-(benzylamino)-4-methylpyrimidine-5-carboxylate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(benzylamino)-4-methylpyrimidine-5-carboxylate. The TPSA of 64.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(benzylamino)-4-methylpyrimidine-5-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-(benzylamino)-4-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.
Frequently Asked Questions
What is the CAS number of Ethyl 2-(benzylamino)-4-methylpyrimidine-5-carboxylate?
The CAS number of Ethyl 2-(benzylamino)-4-methylpyrimidine-5-carboxylate is 108123-81-5.
What is the molecular formula of Ethyl 2-(benzylamino)-4-methylpyrimidine-5-carboxylate?
The molecular formula of Ethyl 2-(benzylamino)-4-methylpyrimidine-5-carboxylate is C15H17N3O2.
What is the molecular weight of Ethyl 2-(benzylamino)-4-methylpyrimidine-5-carboxylate?
The molecular weight of Ethyl 2-(benzylamino)-4-methylpyrimidine-5-carboxylate is 271.13208 g/mol.
Where can I buy Ethyl 2-(benzylamino)-4-methylpyrimidine-5-carboxylate?
You can request a quote for Ethyl 2-(benzylamino)-4-methylpyrimidine-5-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 2-(benzylamino)-4-methylpyrimidine-5-carboxylate?
Yes, CoreyChem provides custom synthesis services for Ethyl 2-(benzylamino)-4-methylpyrimidine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.