Deethylametryne
TL;DR: Deethylametryne (CAS 4147-57-3) is a chemical compound with molecular formula C7H13N5S and molecular weight 199.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methylsulfanyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine
Also Known As: Deethylametryne, Desethylametryne, Ametryn Impurity 2, GS 11354, 1,3,5-Triazine-2,4-diamine, N-(1-methylethyl)-6-(methylthio)-
| Molecular Formula | C7H13N5S |
|---|---|
| Molecular Weight | 199.09 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 199.08917 |
| Heavy Atoms | 13 |
| Complexity | 154.0 |
Chemical Identifiers
| CAS Number | 4147-57-3 |
|---|---|
| SMILES | CC(C)NC1=NC(=NC(=N1)N)SC |
| InChIKey | PWERJYSEXWGFLB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Deethylametryne (CAS 4147-57-3), with molecular formula C7H13N5S and molecular weight 199.09 g/mol. IUPAC: 6-methylsulfanyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine.
Chemical Property Profile of Deethylametryne
Property Insights of Deethylametryne
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Deethylametryne. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Deethylametryne. Following Lipinski's Rule of Five, Deethylametryne has 2 hydrogen bond donor(s) and 6 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 Deethylametryne?
The CAS number of Deethylametryne is 4147-57-3.
What is the molecular formula of Deethylametryne?
The molecular formula of Deethylametryne is C7H13N5S.
What is the molecular weight of Deethylametryne?
The molecular weight of Deethylametryne is 199.09 g/mol.
Where can I buy Deethylametryne?
You can request a quote for Deethylametryne directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Deethylametryne?
Yes, KEHONG BIO provides custom synthesis services for Deethylametryne and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.