4-(Methylthio)(1)benzothieno(3,2-d)pyrimidin-2-amine
TL;DR: 4-(Methylthio)(1)benzothieno(3,2-d)pyrimidin-2-amine (CAS 887585-07-1) is a chemical compound with molecular formula C11H9N3S2 and molecular weight 247.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylsulfanyl-[1]benzothiolo[3,2-d]pyrimidin-2-amine
Also Known As: 4-(methylsulfanyl)[1]benzothieno[3,2-d]pyrimidin-2-ylamine, 4-(Methylthio)[1]benzothieno[3,2-d]pyrimidin-2-amine, 4-methylsulfanyl-[1]benzothiolo[3,2-d]pyrimidin-2-amine, AP-782/41885536, 4-(Methylthio)(1)benzothieno(3,2-d)pyrimidin-2-amine
| Molecular Formula | C11H9N3S2 |
|---|---|
| Molecular Weight | 247.02 g/mol |
| LogP | 3.1486 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 247.02379 |
| Heavy Atoms | 16 |
| Complexity | 675.35205 |
Chemical Identifiers
| CAS Number | 887585-07-1 |
|---|---|
| SMILES | CSC1=NC(=NC2=C1SC3=CC=CC=C32)N |
Product Overview
4-(Methylthio)(1)benzothieno(3,2-d)pyrimidin-2-amine (CAS 887585-07-1), with molecular formula C11H9N3S2 and molecular weight 247.02 g/mol. IUPAC: 4-methylsulfanyl-[1]benzothiolo[3,2-d]pyrimidin-2-amine.
Chemical Property Profile of 4-(Methylthio)(1)benzothieno(3,2-d)pyrimidin-2-amine
Property Insights of 4-(Methylthio)(1)benzothieno(3,2-d)pyrimidin-2-amine
The XLogP value of 3.1486 indicates that 4-(Methylthio)(1)benzothieno(3,2-d)pyrimidin-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, 4-(Methylthio)(1)benzothieno(3,2-d)pyrimidin-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Methylthio)(1)benzothieno(3,2-d)pyrimidin-2-amine 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-(Methylthio)(1)benzothieno(3,2-d)pyrimidin-2-amine?
The CAS number of 4-(Methylthio)(1)benzothieno(3,2-d)pyrimidin-2-amine is 887585-07-1.
What is the molecular formula of 4-(Methylthio)(1)benzothieno(3,2-d)pyrimidin-2-amine?
The molecular formula of 4-(Methylthio)(1)benzothieno(3,2-d)pyrimidin-2-amine is C11H9N3S2.
What is the molecular weight of 4-(Methylthio)(1)benzothieno(3,2-d)pyrimidin-2-amine?
The molecular weight of 4-(Methylthio)(1)benzothieno(3,2-d)pyrimidin-2-amine is 247.02 g/mol.
Where can I buy 4-(Methylthio)(1)benzothieno(3,2-d)pyrimidin-2-amine?
You can request a quote for 4-(Methylthio)(1)benzothieno(3,2-d)pyrimidin-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Methylthio)(1)benzothieno(3,2-d)pyrimidin-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 4-(Methylthio)(1)benzothieno(3,2-d)pyrimidin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.