TL;DR: 2-Chloromethyl-4,6-diphenyl-(1,3,5)triazine (CAS 145317-37-9) is a chemical compound with molecular formula C16H12ClN3 and molecular weight 281.07196 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(chloromethyl)-4,6-diphenyl-1,3,5-triazine
Also Known As: 2-(chloromethyl)-4,6-diphenyl-1,3,5-triazine, 2-CHLOROMETHYL-4,6-DIPHENYL-(1,3,5)TRIAZINE, 683-451-1
| Molecular Formula | C16H12ClN3 |
| Molecular Weight | 281.07196 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 38.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.07196 Da |
| Heavy Atoms | 20 |
| Complexity | 261.0 |
| SMILES | C1=CC=C(C=C1)C2=NC(=NC(=N2)CCl)C3=CC=CC=C3 |
| InChIKey | CNVGLBUTPMEUDF-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that 2-Chloromethyl-4,6-diphenyl-(1,3,5)triazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.7 Ų, 2-Chloromethyl-4,6-diphenyl-(1,3,5)triazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloromethyl-4,6-diphenyl-(1,3,5)triazine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Chloromethyl-4,6-diphenyl-(1,3,5)triazine is 145317-37-9.
The molecular formula of 2-Chloromethyl-4,6-diphenyl-(1,3,5)triazine is C16H12ClN3.
The molecular weight of 2-Chloromethyl-4,6-diphenyl-(1,3,5)triazine is 281.07196 g/mol.
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