TL;DR: 1,3,5-Triazine, 2,4-dimethoxy-6-methyl- (CAS 4000-78-6) is a chemical compound with molecular formula C6H9N3O2 and molecular weight 155.06947 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,4-dimethoxy-6-methyl-1,3,5-triazine
Also Known As: 2,4-Dimethoxy-6-methyl-1,3,5-triazine, Benzenethiol, 2,5-dimethyl-, 1,3,5-Triazine, 2,4-dimethoxy-6-methyl-, 1,3,5-Triazine,2,4-dimethoxy-6-methyl, J1.553.694B
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C6H9N3O2 |
| Molecular Weight | 155.06947 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 57.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 155.06947 Da |
| Heavy Atoms | 11 |
| Complexity | 110.0 |
| SMILES | CC1=NC(=NC(=N1)OC)OC |
| InChIKey | SSJOYUWBJVZCJV-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,5-Triazine, 2,4-dimethoxy-6-methyl-. With a topological polar surface area (TPSA) of 57.1 Ų, 1,3,5-Triazine, 2,4-dimethoxy-6-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,5-Triazine, 2,4-dimethoxy-6-methyl- has 0 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 1,3,5-Triazine, 2,4-dimethoxy-6-methyl- is 4000-78-6.
The molecular formula of 1,3,5-Triazine, 2,4-dimethoxy-6-methyl- is C6H9N3O2.
The molecular weight of 1,3,5-Triazine, 2,4-dimethoxy-6-methyl- is 155.06947 g/mol.
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