4-(Bis(ethylthio)methyl)-2-pyrimidinamine
TL;DR: 4-(Bis(ethylthio)methyl)-2-pyrimidinamine (CAS 338975-33-0) is a chemical compound with molecular formula C9H15N3S2 and molecular weight 229.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[bis(ethylsulfanyl)methyl]pyrimidin-2-amine
Also Known As: 4-[bis(ethylsulfanyl)methyl]pyrimidin-2-amine, 4-[bis(ethylsulfanyl)methyl]-2-pyrimidinylamine, 4-[Bis(ethylthio)methyl]-2-pyrimidinamine, 4-(Bis(ethylthio)methyl)-2-pyrimidinamine, RefChem:288587
| Molecular Formula | C9H15N3S2 |
|---|---|
| Molecular Weight | 229.07 g/mol |
| LogP | 2.5636 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 229.07074 |
| Heavy Atoms | 14 |
| Complexity | 274.5145 |
Chemical Identifiers
| CAS Number | 338975-33-0 |
|---|---|
| SMILES | CCSC(C1=NC(=NC=C1)N)SCC |
Product Overview
4-(Bis(ethylthio)methyl)-2-pyrimidinamine (CAS 338975-33-0), with molecular formula C9H15N3S2 and molecular weight 229.07 g/mol. IUPAC: 4-[bis(ethylsulfanyl)methyl]pyrimidin-2-amine.
Chemical Property Profile of 4-(Bis(ethylthio)methyl)-2-pyrimidinamine
Property Insights of 4-(Bis(ethylthio)methyl)-2-pyrimidinamine
The XLogP value of 2.5636 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Bis(ethylthio)methyl)-2-pyrimidinamine. With a topological polar surface area (TPSA) of 51.8 Ų, 4-(Bis(ethylthio)methyl)-2-pyrimidinamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Bis(ethylthio)methyl)-2-pyrimidinamine has 1 hydrogen bond donor(s) and 5 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 4-(Bis(ethylthio)methyl)-2-pyrimidinamine?
The CAS number of 4-(Bis(ethylthio)methyl)-2-pyrimidinamine is 338975-33-0.
What is the molecular formula of 4-(Bis(ethylthio)methyl)-2-pyrimidinamine?
The molecular formula of 4-(Bis(ethylthio)methyl)-2-pyrimidinamine is C9H15N3S2.
What is the molecular weight of 4-(Bis(ethylthio)methyl)-2-pyrimidinamine?
The molecular weight of 4-(Bis(ethylthio)methyl)-2-pyrimidinamine is 229.07 g/mol.
Where can I buy 4-(Bis(ethylthio)methyl)-2-pyrimidinamine?
You can request a quote for 4-(Bis(ethylthio)methyl)-2-pyrimidinamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Bis(ethylthio)methyl)-2-pyrimidinamine?
Yes, KEHONG BIO provides custom synthesis services for 4-(Bis(ethylthio)methyl)-2-pyrimidinamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.