ethanesulfonic acid- 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(morpholin-4-yl)ethanone(1:1)
TL;DR: ethanesulfonic acid- 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(morpholin-4-yl)ethanone(1:1) (CAS 50868-43-4) is a chemical compound with molecular formula C19H30N6O6S and molecular weight 470.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]-1-morpholin-4-ylethanone;ethanesulfonic acid
Also Known As: ethanesulfonic acid- 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(morpholin-4-yl)ethanone(1:1), 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]-1, 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]-1-morpholin-4-yl-ethanone, 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]-1-morpholin-4-ylethanone; ethanesulfonic acid, 2-[3-(4,6-Diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]-1-morpholin-4-ylethanone;ethanesulfonic acid
| Molecular Formula | C19H30N6O6S |
|---|---|
| Molecular Weight | 470.19 g/mol |
| LogP | 0.0038 |
| Topological Polar Surface Area | 182.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 470.19476 |
| Heavy Atoms | 32 |
| Complexity | 690.0 |
Chemical Identifiers
| CAS Number | 50868-43-4 |
|---|---|
| SMILES | CCS(=O)(=O)O.CC1(N=C(N=C(N1C2=CC(=CC=C2)OCC(=O)N3CCOCC3)N)N)C |
| InChIKey | OOFXDFKEXOJMNL-UHFFFAOYSA-N |
Product Overview
ethanesulfonic acid- 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(morpholin-4-yl)ethanone(1:1) (CAS 50868-43-4), with molecular formula C19H30N6O6S and molecular weight 470.19 g/mol. IUPAC: 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]-1-morpholin-4-ylethanone;ethanesulfonic acid.
Chemical Property Profile of ethanesulfonic acid- 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(morpholin-4-yl)ethanone(1:1)
Property Insights of ethanesulfonic acid- 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(morpholin-4-yl)ethanone(1:1)
The XLogP value of 0.0038 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethanesulfonic acid- 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(morpholin-4-yl)ethanone(1:1). The TPSA of 182.0 Ų indicates high polarity, suggesting ethanesulfonic acid- 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(morpholin-4-yl)ethanone(1:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ethanesulfonic acid- 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(morpholin-4-yl)ethanone(1:1) has 3 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 ethanesulfonic acid- 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(morpholin-4-yl)ethanone(1:1)?
The CAS number of ethanesulfonic acid- 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(morpholin-4-yl)ethanone(1:1) is 50868-43-4.
What is the molecular formula of ethanesulfonic acid- 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(morpholin-4-yl)ethanone(1:1)?
The molecular formula of ethanesulfonic acid- 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(morpholin-4-yl)ethanone(1:1) is C19H30N6O6S.
What is the molecular weight of ethanesulfonic acid- 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(morpholin-4-yl)ethanone(1:1)?
The molecular weight of ethanesulfonic acid- 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(morpholin-4-yl)ethanone(1:1) is 470.19 g/mol.
Where can I buy ethanesulfonic acid- 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(morpholin-4-yl)ethanone(1:1)?
You can request a quote for ethanesulfonic acid- 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(morpholin-4-yl)ethanone(1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethanesulfonic acid- 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(morpholin-4-yl)ethanone(1:1)?
Yes, KEHONG BIO provides custom synthesis services for ethanesulfonic acid- 2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(morpholin-4-yl)ethanone(1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.