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2-(methylsulfanyl)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one
TL;DR: 2-(methylsulfanyl)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one (CAS 338779-17-2) is a chemical compound with molecular formula C13H10N2OS2 and molecular weight 274.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanyl-3-phenylthieno[3,2-d]pyrimidin-4-one
Also Known As: Bionet2_000314, 2-(methylsulfanyl)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one, 2-(methylthio)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one, 2-methylsulfanyl-3-phenylthieno[3,2-d]pyrimidin-4-one, 2-(methylsulfanyl)-3-phenyl-3H,4H-thieno[3,2-d]pyrimidin-4-one
| Molecular Formula | C13H10N2OS2 |
|---|---|
| Molecular Weight | 274.02 g/mol |
| LogP | 3.1691 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 274.02347 |
| Heavy Atoms | 18 |
| Complexity | 746.5223 |
Chemical Identifiers
| CAS Number | 338779-17-2 |
|---|---|
| SMILES | CSC1=NC2=C(C(=O)N1C3=CC=CC=C3)SC=C2 |
Product Overview
2-(methylsulfanyl)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one (CAS 338779-17-2), with molecular formula C13H10N2OS2 and molecular weight 274.02 g/mol. IUPAC: 2-methylsulfanyl-3-phenylthieno[3,2-d]pyrimidin-4-one.
Chemical Property Profile of 2-(methylsulfanyl)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one
Property Insights of 2-(methylsulfanyl)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one
The XLogP value of 3.1691 indicates that 2-(methylsulfanyl)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 2-(methylsulfanyl)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(methylsulfanyl)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one has 0 hydrogen bond donor(s) and 4 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 2-(methylsulfanyl)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one?
The CAS number of 2-(methylsulfanyl)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one is 338779-17-2.
What is the molecular formula of 2-(methylsulfanyl)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one?
The molecular formula of 2-(methylsulfanyl)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one is C13H10N2OS2.
What is the molecular weight of 2-(methylsulfanyl)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one?
The molecular weight of 2-(methylsulfanyl)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one is 274.02 g/mol.
Where can I buy 2-(methylsulfanyl)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one?
You can request a quote for 2-(methylsulfanyl)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(methylsulfanyl)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(methylsulfanyl)-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.