6-(1-chloroethyl)-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine
TL;DR: 6-(1-chloroethyl)-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine (CAS 104622-25-5) is a chemical compound with molecular formula C12H14ClN5 and molecular weight 263.09378 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-(1-chloroethyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine
Also Known As: KSC-16-9, 6-(1-chloroethyl)-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine, 6-(1-chloro-ethyl)-N-o-tolyl-[1,3,5]triazine-2,4-diamine, 6-(1-chloroethyl)-N2-(o-tolyl)-1,3,5-triazine-2,4-diamine, [4-amino-6-(chloroethyl)(1,3,5-triazin-2-yl)](2-methylphenyl)amine
Technical Specifications
| Molecular Formula | C12H14ClN5 |
| Molecular Weight | 263.09378 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 263.09378 Da |
| Heavy Atoms | 18 |
| Complexity | 265.0 |
| SMILES | CC1=CC=CC=C1NC2=NC(=NC(=N2)N)C(C)Cl |
| InChIKey | NDWDMUOGXJNXAK-UHFFFAOYSA-N |
Chemical Property Profile of 6-(1-chloroethyl)-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine
Property Insights of 6-(1-chloroethyl)-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(1-chloroethyl)-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(1-chloroethyl)-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine. Following Lipinski's Rule of Five, 6-(1-chloroethyl)-N-(2-methylphenyl)-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.
Frequently Asked Questions
What is the CAS number of 6-(1-chloroethyl)-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine?
The CAS number of 6-(1-chloroethyl)-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine is 104622-25-5.
What is the molecular formula of 6-(1-chloroethyl)-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine?
The molecular formula of 6-(1-chloroethyl)-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine is C12H14ClN5.
What is the molecular weight of 6-(1-chloroethyl)-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine?
The molecular weight of 6-(1-chloroethyl)-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine is 263.09378 g/mol.
Where can I buy 6-(1-chloroethyl)-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine?
You can request a quote for 6-(1-chloroethyl)-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-(1-chloroethyl)-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine?
Yes, CoreyChem provides custom synthesis services for 6-(1-chloroethyl)-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.