N-(3-chlorophenyl)-2-(2-pyrimidinylsulfanyl)acetamide
TL;DR: N-(3-chlorophenyl)-2-(2-pyrimidinylsulfanyl)acetamide (CAS 329079-22-3) is a chemical compound with molecular formula C12H10ClN3OS and molecular weight 279.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide
Also Known As: N-(3-chlorophenyl)-2-(2-pyrimidinylsulfanyl)acetamide, N-(3-chlorophenyl)-2-(pyrimidin-2-ylsulfanyl)acetamide, n-(3-Chlorophenyl)-2-(pyrimidin-2-ylthio)acetamide, N-(3-chlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide, AA-768/32248047
| Molecular Formula | C12H10ClN3OS |
|---|---|
| Molecular Weight | 279.02 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 80.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 279.02332 |
| Heavy Atoms | 18 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 329079-22-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)NC(=O)CSC2=NC=CC=N2 |
| InChIKey | MJDUNMLRTRDQIB-UHFFFAOYSA-N |
Product Overview
N-(3-chlorophenyl)-2-(2-pyrimidinylsulfanyl)acetamide (CAS 329079-22-3), with molecular formula C12H10ClN3OS and molecular weight 279.02 g/mol. IUPAC: N-(3-chlorophenyl)-2-pyrimidin-2-ylsulfanylacetamide.
Chemical Property Profile of N-(3-chlorophenyl)-2-(2-pyrimidinylsulfanyl)acetamide
Property Insights of N-(3-chlorophenyl)-2-(2-pyrimidinylsulfanyl)acetamide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-chlorophenyl)-2-(2-pyrimidinylsulfanyl)acetamide. The TPSA of 80.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-chlorophenyl)-2-(2-pyrimidinylsulfanyl)acetamide. Following Lipinski's Rule of Five, N-(3-chlorophenyl)-2-(2-pyrimidinylsulfanyl)acetamide 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-(3-chlorophenyl)-2-(2-pyrimidinylsulfanyl)acetamide?
The CAS number of N-(3-chlorophenyl)-2-(2-pyrimidinylsulfanyl)acetamide is 329079-22-3.
What is the molecular formula of N-(3-chlorophenyl)-2-(2-pyrimidinylsulfanyl)acetamide?
The molecular formula of N-(3-chlorophenyl)-2-(2-pyrimidinylsulfanyl)acetamide is C12H10ClN3OS.
What is the molecular weight of N-(3-chlorophenyl)-2-(2-pyrimidinylsulfanyl)acetamide?
The molecular weight of N-(3-chlorophenyl)-2-(2-pyrimidinylsulfanyl)acetamide is 279.02 g/mol.
Where can I buy N-(3-chlorophenyl)-2-(2-pyrimidinylsulfanyl)acetamide?
You can request a quote for N-(3-chlorophenyl)-2-(2-pyrimidinylsulfanyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-chlorophenyl)-2-(2-pyrimidinylsulfanyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chlorophenyl)-2-(2-pyrimidinylsulfanyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.