6-(Methylthio)-1,3,5-triazine-2,4-diamine
TL;DR: 6-(Methylthio)-1,3,5-triazine-2,4-diamine (CAS 5397-01-3) is a chemical compound with molecular formula C4H7N5S and molecular weight 157.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methylsulfanyl-1,3,5-triazine-2,4-diamine
Also Known As: Deisopropylprometryn, 6-(Methylthio)-1,3,5-triazine-2,4-diamine, Desethyl-Deisopropylametryne, 1,3,5-Triazine-2,4-diamine, 2-(Methylthio)-4,6-diamino-1,3,5-triazine
| Molecular Formula | C4H7N5S |
|---|---|
| Molecular Weight | 157.04 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 157.04222 |
| Heavy Atoms | 10 |
| Complexity | 99.0 |
Chemical Identifiers
| CAS Number | 5397-01-3 |
|---|---|
| SMILES | CSC1=NC(=NC(=N1)N)N |
| InChIKey | SFPNVVXUUHYBQW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-(Methylthio)-1,3,5-triazine-2,4-diamine (CAS 5397-01-3), with molecular formula C4H7N5S and molecular weight 157.04 g/mol. IUPAC: 6-methylsulfanyl-1,3,5-triazine-2,4-diamine.
Chemical Property Profile of 6-(Methylthio)-1,3,5-triazine-2,4-diamine
Property Insights of 6-(Methylthio)-1,3,5-triazine-2,4-diamine
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(Methylthio)-1,3,5-triazine-2,4-diamine. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(Methylthio)-1,3,5-triazine-2,4-diamine. Following Lipinski's Rule of Five, 6-(Methylthio)-1,3,5-triazine-2,4-diamine 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 6-(Methylthio)-1,3,5-triazine-2,4-diamine?
The CAS number of 6-(Methylthio)-1,3,5-triazine-2,4-diamine is 5397-01-3.
What is the molecular formula of 6-(Methylthio)-1,3,5-triazine-2,4-diamine?
The molecular formula of 6-(Methylthio)-1,3,5-triazine-2,4-diamine is C4H7N5S.
What is the molecular weight of 6-(Methylthio)-1,3,5-triazine-2,4-diamine?
The molecular weight of 6-(Methylthio)-1,3,5-triazine-2,4-diamine is 157.04 g/mol.
Where can I buy 6-(Methylthio)-1,3,5-triazine-2,4-diamine?
You can request a quote for 6-(Methylthio)-1,3,5-triazine-2,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(Methylthio)-1,3,5-triazine-2,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 6-(Methylthio)-1,3,5-triazine-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.