2-Methoxy-2-oxoethyl 4-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate
TL;DR: 2-Methoxy-2-oxoethyl 4-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate (CAS 354550-52-0) is a chemical compound with molecular formula C17H21N5O5 and molecular weight 375.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methoxy-2-oxoethyl) 4-[[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy]benzoate
Also Known As: ChemDiv1_007529, 2-methoxy-2-oxoethyl 4-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate, AL-281/15328172, (2-methoxy-2-oxoethyl) 4-[[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy]benzoate, 2-methoxy-2-oxoethyl 4-((4,6-bis(dimethylamino)-1,3,5-triazin-2-yl)oxy)benzoate
| Molecular Formula | C17H21N5O5 |
|---|---|
| Molecular Weight | 375.15 g/mol |
| LogP | 1.1257 |
| Topological Polar Surface Area | 106.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 375.15427 |
| Heavy Atoms | 27 |
| Complexity | 781.61145 |
Chemical Identifiers
| CAS Number | 354550-52-0 |
|---|---|
| SMILES | CN(C)C1=NC(=NC(=N1)OC2=CC=C(C=C2)C(=O)OCC(=O)OC)N(C)C |
Product Overview
2-Methoxy-2-oxoethyl 4-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate (CAS 354550-52-0), with molecular formula C17H21N5O5 and molecular weight 375.15 g/mol. IUPAC: (2-methoxy-2-oxoethyl) 4-[[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy]benzoate.
Chemical Property Profile of 2-Methoxy-2-oxoethyl 4-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate
Property Insights of 2-Methoxy-2-oxoethyl 4-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate
The XLogP value of 1.1257 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methoxy-2-oxoethyl 4-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate. The TPSA of 106.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methoxy-2-oxoethyl 4-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate. Following Lipinski's Rule of Five, 2-Methoxy-2-oxoethyl 4-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate has 0 hydrogen bond donor(s) and 10 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 2-Methoxy-2-oxoethyl 4-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate?
The CAS number of 2-Methoxy-2-oxoethyl 4-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate is 354550-52-0.
What is the molecular formula of 2-Methoxy-2-oxoethyl 4-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate?
The molecular formula of 2-Methoxy-2-oxoethyl 4-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate is C17H21N5O5.
What is the molecular weight of 2-Methoxy-2-oxoethyl 4-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate?
The molecular weight of 2-Methoxy-2-oxoethyl 4-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate is 375.15 g/mol.
Where can I buy 2-Methoxy-2-oxoethyl 4-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate?
You can request a quote for 2-Methoxy-2-oxoethyl 4-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxy-2-oxoethyl 4-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxy-2-oxoethyl 4-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.