3-[Ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile
TL;DR: 3-[Ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile (CAS 24848-46-2) is a chemical compound with molecular formula C10H12Cl3N5 and molecular weight 307.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile
Also Known As: J1.611.727G, 3-(ETHYL(4-METHYL-6-(TRICHLOROMETHYL)-S-TRIA*)), 3-[ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile, 3-{ethyl[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino}propanenitrile, 3-[Ethyl[4-methyl-6-(trichloromethyl)-s-triazine-2-yl]amino]propionitrile
| Molecular Formula | C10H12Cl3N5 |
|---|---|
| Molecular Weight | 307.02 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 65.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 307.01584 |
| Heavy Atoms | 18 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 24848-46-2 |
|---|---|
| SMILES | CCN(CCC#N)C1=NC(=NC(=N1)C(Cl)(Cl)Cl)C |
| InChIKey | ZLSYCESNYFGGFZ-UHFFFAOYSA-N |
Product Overview
3-[Ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile (CAS 24848-46-2), with molecular formula C10H12Cl3N5 and molecular weight 307.02 g/mol. IUPAC: 3-[ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile.
Chemical Property Profile of 3-[Ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile
Property Insights of 3-[Ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[Ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile. The TPSA of 65.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[Ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile. Following Lipinski's Rule of Five, 3-[Ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[Ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile?
The CAS number of 3-[Ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile is 24848-46-2.
What is the molecular formula of 3-[Ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile?
The molecular formula of 3-[Ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile is C10H12Cl3N5.
What is the molecular weight of 3-[Ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile?
The molecular weight of 3-[Ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile is 307.02 g/mol.
Where can I buy 3-[Ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile?
You can request a quote for 3-[Ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[Ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-[Ethyl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.