Deisopropylametryne
TL;DR: Deisopropylametryne (CAS 4147-58-4) is a chemical compound with molecular formula C6H11N5S and molecular weight 185.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N-ethyl-6-methylsulfanyl-1,3,5-triazine-2,4-diamine
Also Known As: Deisopropylametryne, Desisopropylametryne, N2-Ethyl-6-(methylthio)-1,3,5-triazine-2,4-diamine, 1,3,5-Triazine-2,4-diamine, N-ethyl-6-(methylthio)-, Desethyl-simetryn, Deisopropylametryne
| Molecular Formula | C6H11N5S |
|---|---|
| Molecular Weight | 185.07 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 185.07352 |
| Heavy Atoms | 12 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 4147-58-4 |
|---|---|
| SMILES | CCNC1=NC(=NC(=N1)N)SC |
| InChIKey | CMKCJDAIKRRBDY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Deisopropylametryne (CAS 4147-58-4), with molecular formula C6H11N5S and molecular weight 185.07 g/mol. IUPAC: 2-N-ethyl-6-methylsulfanyl-1,3,5-triazine-2,4-diamine.
Chemical Property Profile of Deisopropylametryne
Property Insights of Deisopropylametryne
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Deisopropylametryne. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Deisopropylametryne. Following Lipinski's Rule of Five, Deisopropylametryne 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 Deisopropylametryne?
The CAS number of Deisopropylametryne is 4147-58-4.
What is the molecular formula of Deisopropylametryne?
The molecular formula of Deisopropylametryne is C6H11N5S.
What is the molecular weight of Deisopropylametryne?
The molecular weight of Deisopropylametryne is 185.07 g/mol.
Where can I buy Deisopropylametryne?
You can request a quote for Deisopropylametryne directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Deisopropylametryne?
Yes, KEHONG BIO provides custom synthesis services for Deisopropylametryne and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.