TL;DR: 4,6-dichloro-1,3,5-triazine-2-carboxylic Acid (CAS 1027054-37-0) is a chemical compound with molecular formula C4HCl2N3O2 and molecular weight 192.94458 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,6-dichloro-1,3,5-triazine-2-carboxylic acid
Also Known As: 4,6-dichloro-1,3,5-triazine-2-carboxylic Acid
| Molecular Formula | C4HCl2N3O2 |
| Molecular Weight | 192.94458 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 76.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.94458 Da |
| Heavy Atoms | 11 |
| Complexity | 157.0 |
| SMILES | C1(=NC(=NC(=N1)Cl)Cl)C(=O)O |
| InChIKey | DYORXYGCTYIKOL-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-dichloro-1,3,5-triazine-2-carboxylic Acid. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-dichloro-1,3,5-triazine-2-carboxylic Acid. Following Lipinski's Rule of Five, 4,6-dichloro-1,3,5-triazine-2-carboxylic Acid 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 4,6-dichloro-1,3,5-triazine-2-carboxylic Acid is 1027054-37-0.
The molecular formula of 4,6-dichloro-1,3,5-triazine-2-carboxylic Acid is C4HCl2N3O2.
The molecular weight of 4,6-dichloro-1,3,5-triazine-2-carboxylic Acid is 192.94458 g/mol.
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