2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)-
TL;DR: 2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)- (CAS 55417-10-2) is a chemical compound with molecular formula C20H27Cl2N5OS and molecular weight 455.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2-N-(4-chlorophenyl)-4-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-N-methyl-5-methylsulfanylpyrimidine-2,4-diamine
Also Known As: 2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)-, 4-Chloro-N-(4-chlorophenyl)-6-{[2-(2,6-dimethylmorpholin-4-yl)ethyl]imino}-N-methyl-5-(methylsulfanyl)-1,6-dihydropyrimidin-2-amine, 6-chloro-2-N-(4-chlorophenyl)-4-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-N-methyl-5-methylsulfanylpyrimidine-2,4-diamine, RefChem:246921
| Molecular Formula | C20H27Cl2N5OS |
|---|---|
| Molecular Weight | 455.13 g/mol |
| LogP | 4.7943 |
| Topological Polar Surface Area | 53.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 455.13135 |
| Heavy Atoms | 29 |
| Complexity | 813.26404 |
Chemical Identifiers
| CAS Number | 55417-10-2 |
|---|---|
| SMILES | CC1CN(CC(O1)C)CCNC2=C(C(=NC(=N2)N(C)C3=CC=C(C=C3)Cl)Cl)SC |
Product Overview
2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)- (CAS 55417-10-2), with molecular formula C20H27Cl2N5OS and molecular weight 455.13 g/mol. IUPAC: 6-chloro-2-N-(4-chlorophenyl)-4-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-N-methyl-5-methylsulfanylpyrimidine-2,4-diamine.
Chemical Property Profile of 2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)-
Property Insights of 2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)-
The XLogP value of 4.7943 indicates that 2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.52 Ų, 2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)- has 1 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 2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)-?
The CAS number of 2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)- is 55417-10-2.
What is the molecular formula of 2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)-?
The molecular formula of 2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)- is C20H27Cl2N5OS.
What is the molecular weight of 2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)-?
The molecular weight of 2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)- is 455.13 g/mol.
Where can I buy 2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)-?
You can request a quote for 2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)-?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.