BAS 02789404
TL;DR: BAS 02789404 (CAS 371952-12-4) is a chemical compound with molecular formula C17H21Cl2N5O3S and molecular weight 445.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]sulfanyl]ethyl 2-(2,4-dichlorophenoxy)acetate
Also Known As: BAS 02789404, 2-((4,6-bis(ethylamino)-1,3,5-triazin-2-yl)thio)ethyl 2-(2,4-dichlorophenoxy)acetate, 2-[[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]sulfanyl]ethyl 2-(2,4-dichlorophenoxy)acetate, 2-[4,6-bis(ethylamino)-1,3,5-triazin-2-ylthio]ethyl 2-(2,4-dichlorophenoxy)ace tate, 2-{[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]sulfanyl}ethyl (2,4-dichlorophenoxy)acetate
| Molecular Formula | C17H21Cl2N5O3S |
|---|---|
| Molecular Weight | 445.07 g/mol |
| LogP | 3.7563 |
| Topological Polar Surface Area | 98.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 445.07422 |
| Heavy Atoms | 28 |
| Complexity | 773.1333 |
Chemical Identifiers
| CAS Number | 371952-12-4 |
|---|---|
| SMILES | CCNC1=NC(=NC(=N1)SCCOC(=O)COC2=C(C=C(C=C2)Cl)Cl)NCC |
Product Overview
BAS 02789404 (CAS 371952-12-4), with molecular formula C17H21Cl2N5O3S and molecular weight 445.07 g/mol. IUPAC: 2-[[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]sulfanyl]ethyl 2-(2,4-dichlorophenoxy)acetate.
Chemical Property Profile of BAS 02789404
Property Insights of BAS 02789404
The XLogP value of 3.7563 indicates that BAS 02789404 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.26 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02789404. Following Lipinski's Rule of Five, BAS 02789404 has 2 hydrogen bond donor(s) and 9 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 BAS 02789404?
The CAS number of BAS 02789404 is 371952-12-4.
What is the molecular formula of BAS 02789404?
The molecular formula of BAS 02789404 is C17H21Cl2N5O3S.
What is the molecular weight of BAS 02789404?
The molecular weight of BAS 02789404 is 445.07 g/mol.
Where can I buy BAS 02789404?
You can request a quote for BAS 02789404 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02789404?
Yes, KEHONG BIO provides custom synthesis services for BAS 02789404 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.