1-(Biphenyl-4-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone
TL;DR: 1-(Biphenyl-4-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone (CAS 443121-69-5) is a chemical compound with molecular formula C18H14N2OS and molecular weight 306.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-phenylphenyl)-2-pyrimidin-2-ylsulfanylethanone
Also Known As: BAS 03673743, 1-(biphenyl-4-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone, 1-(4-phenylphenyl)-2-pyrimidin-2-ylsulfanylethanone, 1-(4-phenylphenyl)-2-pyrimidin-2-ylthioethan-1-one, 1-Biphenyl-4-yl-2-(pyrimidin-2-ylsulfanyl)-ethanone
| Molecular Formula | C18H14N2OS |
|---|---|
| Molecular Weight | 306.08 g/mol |
| LogP | 4.1186 |
| Topological Polar Surface Area | 42.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 306.08267 |
| Heavy Atoms | 22 |
| Complexity | 743.06055 |
Chemical Identifiers
| CAS Number | 443121-69-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CSC3=NC=CC=N3 |
Product Overview
1-(Biphenyl-4-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone (CAS 443121-69-5), with molecular formula C18H14N2OS and molecular weight 306.08 g/mol. IUPAC: 1-(4-phenylphenyl)-2-pyrimidin-2-ylsulfanylethanone.
Chemical Property Profile of 1-(Biphenyl-4-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone
Property Insights of 1-(Biphenyl-4-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone
The XLogP value of 4.1186 indicates that 1-(Biphenyl-4-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.85 Ų, 1-(Biphenyl-4-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Biphenyl-4-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone 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 1-(Biphenyl-4-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone?
The CAS number of 1-(Biphenyl-4-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone is 443121-69-5.
What is the molecular formula of 1-(Biphenyl-4-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone?
The molecular formula of 1-(Biphenyl-4-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone is C18H14N2OS.
What is the molecular weight of 1-(Biphenyl-4-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone?
The molecular weight of 1-(Biphenyl-4-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone is 306.08 g/mol.
Where can I buy 1-(Biphenyl-4-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone?
You can request a quote for 1-(Biphenyl-4-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Biphenyl-4-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(Biphenyl-4-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.