TL;DR: 1,3,5-Triazine-2,4-diamine, 6-methyl-N-(phenylmethyl)- (CAS 112878-50-9) is a chemical compound with molecular formula C11H13N5 and molecular weight 215.1171 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-N-benzyl-6-methyl-1,3,5-triazine-2,4-diamine
Also Known As: 1,3,5-Triazine-2,4-diamine, 6-methyl-N-(phenylmethyl)-, 2-N-benzyl-6-methyl-1,3,5-triazine-2,4-diamine, N2-benzyl-6-methyl-1,3,5-triazine-2,4-diamine, N~2~-Benzyl-6-methyl-1,3,5-triazine-2,4-diamine, 1,3,5-Triazine-2,4-diamine,6-methyl-N-(phenylmethyl)
| Molecular Formula | C11H13N5 |
| Molecular Weight | 215.1171 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 215.1171 Da |
| Heavy Atoms | 16 |
| Complexity | 205.0 |
| SMILES | CC1=NC(=NC(=N1)NCC2=CC=CC=C2)N |
| InChIKey | STZWLZUMSSQFTO-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,5-Triazine-2,4-diamine, 6-methyl-N-(phenylmethyl)-. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,5-Triazine-2,4-diamine, 6-methyl-N-(phenylmethyl)-. Following Lipinski's Rule of Five, 1,3,5-Triazine-2,4-diamine, 6-methyl-N-(phenylmethyl)- has 2 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-diamine, 6-methyl-N-(phenylmethyl)- is 112878-50-9.
The molecular formula of 1,3,5-Triazine-2,4-diamine, 6-methyl-N-(phenylmethyl)- is C11H13N5.
The molecular weight of 1,3,5-Triazine-2,4-diamine, 6-methyl-N-(phenylmethyl)- is 215.1171 g/mol.
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