N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide
TL;DR: N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide (CAS 455300-94-4) is a chemical compound with molecular formula C12H9Cl2N3OS and molecular weight 312.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide
Also Known As: N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide, N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylthioacetamide, N-(2,5-dichlorophenyl)-2-(pyrimidin-2-ylsulfanyl)acetamide, N-(2,5-DICHLOROPHENYL)-2-(2-PYRIMIDINYLSULFANYL)ACETAMIDE
| Molecular Formula | C12H9Cl2N3OS |
|---|---|
| Molecular Weight | 312.98 g/mol |
| LogP | 3.5142 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.98434 |
| Heavy Atoms | 19 |
| Complexity | 580.44214 |
Chemical Identifiers
| CAS Number | 455300-94-4 |
|---|---|
| SMILES | C1=CN=C(N=C1)SCC(=O)NC2=C(C=CC(=C2)Cl)Cl |
Product Overview
N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide (CAS 455300-94-4), with molecular formula C12H9Cl2N3OS and molecular weight 312.98 g/mol. IUPAC: N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide.
Chemical Property Profile of N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide
Property Insights of N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide
The XLogP value of 3.5142 indicates that N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide has 1 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 N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide?
The CAS number of N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide is 455300-94-4.
What is the molecular formula of N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide?
The molecular formula of N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide is C12H9Cl2N3OS.
What is the molecular weight of N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide?
The molecular weight of N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide is 312.98 g/mol.
Where can I buy N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide?
You can request a quote for N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.