6-((4,6-bis(isopropylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3-yl 4-methylbenzenesulfonate
TL;DR: 6-((4,6-bis(isopropylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3-yl 4-methylbenzenesulfonate (CAS 488745-10-4) is a chemical compound with molecular formula C20H25N7O4S and molecular weight 459.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-[[4,6-bis(propan-2-ylamino)-1,3,5-triazin-2-yl]oxy]pyridazin-3-yl] 4-methylbenzenesulfonate
Also Known As: 6-((4,6-bis(isopropylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3-yl 4-methylbenzenesulfonate, [6-[[4,6-bis(propan-2-ylamino)-1,3,5-triazin-2-yl]oxy]pyridazin-3-yl] 4-methylbenzenesulfonate, 6-{[4,6-bis(propan-2-ylamino)-1,3,5-triazin-2-yl]oxy}pyridazin-3-yl 4-methylbenzenesulfonate
| Molecular Formula | C20H25N7O4S |
|---|---|
| Molecular Weight | 459.17 g/mol |
| LogP | 3.17062 |
| Topological Polar Surface Area | 141.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 459.16888 |
| Heavy Atoms | 32 |
| Complexity | 1123.3207 |
Chemical Identifiers
| CAS Number | 488745-10-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=NN=C(C=C2)OC3=NC(=NC(=N3)NC(C)C)NC(C)C |
Product Overview
6-((4,6-bis(isopropylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3-yl 4-methylbenzenesulfonate (CAS 488745-10-4), with molecular formula C20H25N7O4S and molecular weight 459.17 g/mol. IUPAC: [6-[[4,6-bis(propan-2-ylamino)-1,3,5-triazin-2-yl]oxy]pyridazin-3-yl] 4-methylbenzenesulfonate.
Chemical Property Profile of 6-((4,6-bis(isopropylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3-yl 4-methylbenzenesulfonate
Property Insights of 6-((4,6-bis(isopropylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3-yl 4-methylbenzenesulfonate
The XLogP value of 3.17062 indicates that 6-((4,6-bis(isopropylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3-yl 4-methylbenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.11 Ų indicates high polarity, suggesting 6-((4,6-bis(isopropylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3-yl 4-methylbenzenesulfonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6-((4,6-bis(isopropylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3-yl 4-methylbenzenesulfonate has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-((4,6-bis(isopropylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3-yl 4-methylbenzenesulfonate?
The CAS number of 6-((4,6-bis(isopropylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3-yl 4-methylbenzenesulfonate is 488745-10-4.
What is the molecular formula of 6-((4,6-bis(isopropylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3-yl 4-methylbenzenesulfonate?
The molecular formula of 6-((4,6-bis(isopropylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3-yl 4-methylbenzenesulfonate is C20H25N7O4S.
What is the molecular weight of 6-((4,6-bis(isopropylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3-yl 4-methylbenzenesulfonate?
The molecular weight of 6-((4,6-bis(isopropylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3-yl 4-methylbenzenesulfonate is 459.17 g/mol.
Where can I buy 6-((4,6-bis(isopropylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3-yl 4-methylbenzenesulfonate?
You can request a quote for 6-((4,6-bis(isopropylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3-yl 4-methylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-((4,6-bis(isopropylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3-yl 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 6-((4,6-bis(isopropylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3-yl 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.