methyl 2-(N-(4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl)cyanamido)acetate
TL;DR: methyl 2-(N-(4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl)cyanamido)acetate (CAS 334507-23-2) is a chemical compound with molecular formula C9H11ClN6O2 and molecular weight 270.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl]-cyanoamino]acetate
Also Known As: BAS 01077678, methyl N-[4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl]-N-cyanoglycinate, [(4-Chloro-6-dimethylamino-[1,3,5]triazin-2-yl)-cyano-amino]-acetic acid methyl, methyl 2-(N-(4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl)cyanamido)acetate, methyl 2-[[4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl]-cyanoamino]acetate
| Molecular Formula | C9H11ClN6O2 |
|---|---|
| Molecular Weight | 270.06 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 95.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 270.0632 |
| Heavy Atoms | 18 |
| Complexity | 343.0 |
Chemical Identifiers
| CAS Number | 334507-23-2 |
|---|---|
| SMILES | CN(C)C1=NC(=NC(=N1)Cl)N(CC(=O)OC)C#N |
| InChIKey | CMBPUELNEIBCDH-UHFFFAOYSA-N |
Product Overview
methyl 2-(N-(4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl)cyanamido)acetate (CAS 334507-23-2), with molecular formula C9H11ClN6O2 and molecular weight 270.06 g/mol. IUPAC: methyl 2-[[4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl]-cyanoamino]acetate.
Chemical Property Profile of methyl 2-(N-(4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl)cyanamido)acetate
Property Insights of methyl 2-(N-(4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl)cyanamido)acetate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 2-(N-(4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl)cyanamido)acetate. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-(N-(4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl)cyanamido)acetate. Following Lipinski's Rule of Five, methyl 2-(N-(4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl)cyanamido)acetate has 0 hydrogen bond donor(s) and 8 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 methyl 2-(N-(4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl)cyanamido)acetate?
The CAS number of methyl 2-(N-(4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl)cyanamido)acetate is 334507-23-2.
What is the molecular formula of methyl 2-(N-(4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl)cyanamido)acetate?
The molecular formula of methyl 2-(N-(4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl)cyanamido)acetate is C9H11ClN6O2.
What is the molecular weight of methyl 2-(N-(4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl)cyanamido)acetate?
The molecular weight of methyl 2-(N-(4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl)cyanamido)acetate is 270.06 g/mol.
Where can I buy methyl 2-(N-(4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl)cyanamido)acetate?
You can request a quote for methyl 2-(N-(4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl)cyanamido)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-(N-(4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl)cyanamido)acetate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-(N-(4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl)cyanamido)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.