![1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea structure](/static/products/3080/30804-91-2.webp)
1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea
TL;DR: 1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea (CAS 30804-91-2) is a chemical compound with molecular formula C8H10Cl3N5O and molecular weight 297.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea
Also Known As: J1.614.818K, 1,1-dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea, 1,1-DIMETHYL-3-(4-METHYL-6-(TRICHLOROMETHYL)-*), 1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-s-triazine-2-yl]urea, N,N-Dimethyl-N'-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea
| Molecular Formula | C8H10Cl3N5O |
|---|---|
| Molecular Weight | 297.00 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 71.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 296.9951 |
| Heavy Atoms | 17 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 30804-91-2 |
|---|---|
| SMILES | CC1=NC(=NC(=N1)NC(=O)N(C)C)C(Cl)(Cl)Cl |
| InChIKey | CIBYOFFSGNROGC-UHFFFAOYSA-N |
Product Overview
1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea (CAS 30804-91-2), with molecular formula C8H10Cl3N5O and molecular weight 297.00 g/mol. IUPAC: 1,1-dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea.
Chemical Property Profile of 1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea
Property Insights of 1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea. The TPSA of 71.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea. Following Lipinski's Rule of Five, 1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea has 1 hydrogen bond donor(s) and 4 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 1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea?
The CAS number of 1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea is 30804-91-2.
What is the molecular formula of 1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea?
The molecular formula of 1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea is C8H10Cl3N5O.
What is the molecular weight of 1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea?
The molecular weight of 1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea is 297.00 g/mol.
Where can I buy 1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea?
You can request a quote for 1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Dimethyl-3-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.