ethanesulfonic acid- 1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(1:1)
TL;DR: ethanesulfonic acid- 1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(1:1) (CAS 15928-38-8) is a chemical compound with molecular formula C23H31Cl2N5O3S and molecular weight 527.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-[4-(2,4-dichlorophenyl)butyl]phenyl]-6,6-dimethyl-1,3,5-triazine-2,4-diamine;ethanesulfonic acid
Also Known As: ethanesulfonic acid- 1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(1:1), 1-[3-[4-(2,4-dichlorophenyl)butyl]phenyl]-6,6-dimethyl-1,3,5-triazine-2,4-diamine,ethanesulfonic acid, 1-[3-[4-(2,4-dichlorophenyl)butyl]phenyl]-6,6-dimethyl-1,3,5-triazine-2,4-diamine; ethanesulfonic acid, Ethanesulfonic acid--1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine (1/1), ethanesulfonic acid-1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(1:1)
| Molecular Formula | C23H31Cl2N5O3S |
|---|---|
| Molecular Weight | 527.15 g/mol |
| LogP | 4.6384 |
| Topological Polar Surface Area | 143.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 527.15247 |
| Heavy Atoms | 34 |
| Complexity | 697.0 |
Chemical Identifiers
| CAS Number | 15928-38-8 |
|---|---|
| SMILES | CCS(=O)(=O)O.CC1(N=C(N=C(N1C2=CC=CC(=C2)CCCCC3=C(C=C(C=C3)Cl)Cl)N)N)C |
| InChIKey | BLOVGRQFZRVPGX-UHFFFAOYSA-N |
Product Overview
ethanesulfonic acid- 1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(1:1) (CAS 15928-38-8), with molecular formula C23H31Cl2N5O3S and molecular weight 527.15 g/mol. IUPAC: 1-[3-[4-(2,4-dichlorophenyl)butyl]phenyl]-6,6-dimethyl-1,3,5-triazine-2,4-diamine;ethanesulfonic acid.
Chemical Property Profile of ethanesulfonic acid- 1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(1:1)
Property Insights of ethanesulfonic acid- 1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(1:1)
The XLogP value of 4.6384 indicates that ethanesulfonic acid- 1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 143.0 Ų indicates high polarity, suggesting ethanesulfonic acid- 1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(1:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ethanesulfonic acid- 1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(1:1) has 3 hydrogen bond donor(s) and 4 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- 1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(1:1)?
The CAS number of ethanesulfonic acid- 1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(1:1) is 15928-38-8.
What is the molecular formula of ethanesulfonic acid- 1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(1:1)?
The molecular formula of ethanesulfonic acid- 1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(1:1) is C23H31Cl2N5O3S.
What is the molecular weight of ethanesulfonic acid- 1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(1:1)?
The molecular weight of ethanesulfonic acid- 1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(1:1) is 527.15 g/mol.
Where can I buy ethanesulfonic acid- 1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(1:1)?
You can request a quote for ethanesulfonic acid- 1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(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- 1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(1:1)?
Yes, KEHONG BIO provides custom synthesis services for ethanesulfonic acid- 1-{3-[4-(2,4-dichlorophenyl)butyl]phenyl}-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine(1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.