![ethanesulfonic acid- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(1:1) structure](/static/products/2541/25415-88-7.webp)
ethanesulfonic acid- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(1:1)
TL;DR: ethanesulfonic acid- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(1:1) (CAS 25415-88-7) is a chemical compound with molecular formula C24H33ClFN7O7S2 and molecular weight 649.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]butylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid
Also Known As: ethanesulfonic acid- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(1:1), 4-[4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-y, 4-[4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]butylcarbamoylamino]benzenesulfonyl fluoride,ethanesulfonic acid, 4-[4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]butylcarbamoylamino]benzenesulfonyl fluoride; ethanesulfonic acid, 4-[4-[2-Chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]butylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid
| Molecular Formula | C24H33ClFN7O7S2 |
|---|---|
| Molecular Weight | 649.16 g/mol |
| LogP | 3.0585 |
| Topological Polar Surface Area | 236.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 649.1555 |
| Heavy Atoms | 42 |
| Complexity | 1040.0 |
Chemical Identifiers
| CAS Number | 25415-88-7 |
|---|---|
| SMILES | CCS(=O)(=O)O.CC1(N=C(N=C(N1C2=CC(=C(C=C2)OCCCCNC(=O)NC3=CC=C(C=C3)S(=O)(=O)F)Cl)N)N)C |
| InChIKey | NENKYKPHSYGBMU-UHFFFAOYSA-N |
Product Overview
ethanesulfonic acid- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(1:1) (CAS 25415-88-7), with molecular formula C24H33ClFN7O7S2 and molecular weight 649.16 g/mol. IUPAC: 4-[4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]butylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid.
Chemical Property Profile of ethanesulfonic acid- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(1:1)
Property Insights of ethanesulfonic acid- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(1:1)
The XLogP value of 3.0585 indicates that ethanesulfonic acid- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 236.0 Ų indicates high polarity, suggesting ethanesulfonic acid- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(1:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ethanesulfonic acid- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(1:1) has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethanesulfonic acid- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(1:1)?
The CAS number of ethanesulfonic acid- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(1:1) is 25415-88-7.
What is the molecular formula of ethanesulfonic acid- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(1:1)?
The molecular formula of ethanesulfonic acid- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(1:1) is C24H33ClFN7O7S2.
What is the molecular weight of ethanesulfonic acid- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(1:1)?
The molecular weight of ethanesulfonic acid- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(1:1) is 649.16 g/mol.
Where can I buy ethanesulfonic acid- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(1:1)?
You can request a quote for ethanesulfonic acid- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(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- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(1:1)?
Yes, KEHONG BIO provides custom synthesis services for ethanesulfonic acid- 4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]butyl}carbamoyl)amino]benzenesulfonyl fluoride(1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.