2,2'-((6-Chloro-1,3,5-triazine-2,4-diyl)diimino)bisethanol
TL;DR: 2,2'-((6-Chloro-1,3,5-triazine-2,4-diyl)diimino)bisethanol (CAS 54581-55-4) is a chemical compound with molecular formula C7H12ClN5O2 and molecular weight 233.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-chloro-6-(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]ethanol
Also Known As: 2,2'-[diimino]bisethanol, 2,2'-[ diimino]bisethanol, EINECS 259-244-3, 2,2'-((6-Chloro-1,3,5-triazine-2,4-diyl)diimino)bisethanol, 2-Chloro-4,6-bis(2-hydroxyethylamino)-s-triazine
| Molecular Formula | C7H12ClN5O2 |
|---|---|
| Molecular Weight | 233.07 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 233.06795 |
| Heavy Atoms | 15 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 54581-55-4 |
|---|---|
| SMILES | C(CO)NC1=NC(=NC(=N1)Cl)NCCO |
| InChIKey | XWGOYJWQFZCFNN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2'-((6-Chloro-1,3,5-triazine-2,4-diyl)diimino)bisethanol (CAS 54581-55-4), with molecular formula C7H12ClN5O2 and molecular weight 233.07 g/mol. IUPAC: 2-[[4-chloro-6-(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]ethanol.
Chemical Property Profile of 2,2'-((6-Chloro-1,3,5-triazine-2,4-diyl)diimino)bisethanol
Property Insights of 2,2'-((6-Chloro-1,3,5-triazine-2,4-diyl)diimino)bisethanol
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2'-((6-Chloro-1,3,5-triazine-2,4-diyl)diimino)bisethanol. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2'-((6-Chloro-1,3,5-triazine-2,4-diyl)diimino)bisethanol. Following Lipinski's Rule of Five, 2,2'-((6-Chloro-1,3,5-triazine-2,4-diyl)diimino)bisethanol has 4 hydrogen bond donor(s) and 7 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 2,2'-((6-Chloro-1,3,5-triazine-2,4-diyl)diimino)bisethanol?
The CAS number of 2,2'-((6-Chloro-1,3,5-triazine-2,4-diyl)diimino)bisethanol is 54581-55-4.
What is the molecular formula of 2,2'-((6-Chloro-1,3,5-triazine-2,4-diyl)diimino)bisethanol?
The molecular formula of 2,2'-((6-Chloro-1,3,5-triazine-2,4-diyl)diimino)bisethanol is C7H12ClN5O2.
What is the molecular weight of 2,2'-((6-Chloro-1,3,5-triazine-2,4-diyl)diimino)bisethanol?
The molecular weight of 2,2'-((6-Chloro-1,3,5-triazine-2,4-diyl)diimino)bisethanol is 233.07 g/mol.
Where can I buy 2,2'-((6-Chloro-1,3,5-triazine-2,4-diyl)diimino)bisethanol?
You can request a quote for 2,2'-((6-Chloro-1,3,5-triazine-2,4-diyl)diimino)bisethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-((6-Chloro-1,3,5-triazine-2,4-diyl)diimino)bisethanol?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-((6-Chloro-1,3,5-triazine-2,4-diyl)diimino)bisethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.