TL;DR: 2-N-ethyl-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine (CAS 27470-98-0) is a chemical compound with molecular formula C6H8Cl3N5 and molecular weight 254.98453 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-N-ethyl-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine
Also Known As: J1.612.270J, 2-N-ethyl-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine, 2-AMINO-4-ETHYLAMINO-6-TRICHLOROMETHYL-S-TRIAZI*, 4-(Ethylamino)-6-(trichloromethyl)-1,3,5-triazine-2-amine, N~2~-Ethyl-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine
| Molecular Formula | C6H8Cl3N5 |
| Molecular Weight | 254.98453 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 254.98453 Da |
| Heavy Atoms | 14 |
| Complexity | 185.0 |
| SMILES | CCNC1=NC(=NC(=N1)N)C(Cl)(Cl)Cl |
| InChIKey | RAUDVLOQTSPUMC-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-N-ethyl-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-N-ethyl-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine. Following Lipinski's Rule of Five, 2-N-ethyl-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine 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 2-N-ethyl-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine is 27470-98-0.
The molecular formula of 2-N-ethyl-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine is C6H8Cl3N5.
The molecular weight of 2-N-ethyl-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine is 254.98453 g/mol.
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