N-(4-sec-butylphenyl)-2-(2-pyrimidinylsulfanyl)acetamide
TL;DR: N-(4-sec-butylphenyl)-2-(2-pyrimidinylsulfanyl)acetamide (CAS 256955-16-5) is a chemical compound with molecular formula C16H19N3OS and molecular weight 301.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-butan-2-ylphenyl)-2-pyrimidin-2-ylsulfanylacetamide
Also Known As: N-(4-sec-butylphenyl)-2-(2-pyrimidinylsulfanyl)acetamide, N-(4-butan-2-ylphenyl)-2-pyrimidin-2-ylsulfanylacetamide, N-(4-sec-Butylphenyl)-2-(2-pyrimidinylthio)acetamide, N-[4-(sec-butyl)phenyl]-2-(2-pyrimidinylsulfanyl)acetamide, AA-768/33244022
| Molecular Formula | C16H19N3OS |
|---|---|
| Molecular Weight | 301.12 g/mol |
| LogP | 3.7209 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 301.12488 |
| Heavy Atoms | 21 |
| Complexity | 571.83575 |
Chemical Identifiers
| CAS Number | 256955-16-5 |
|---|---|
| SMILES | CCC(C)C1=CC=C(C=C1)NC(=O)CSC2=NC=CC=N2 |
Product Overview
N-(4-sec-butylphenyl)-2-(2-pyrimidinylsulfanyl)acetamide (CAS 256955-16-5), with molecular formula C16H19N3OS and molecular weight 301.12 g/mol. IUPAC: N-(4-butan-2-ylphenyl)-2-pyrimidin-2-ylsulfanylacetamide.
Chemical Property Profile of N-(4-sec-butylphenyl)-2-(2-pyrimidinylsulfanyl)acetamide
Property Insights of N-(4-sec-butylphenyl)-2-(2-pyrimidinylsulfanyl)acetamide
The XLogP value of 3.7209 indicates that N-(4-sec-butylphenyl)-2-(2-pyrimidinylsulfanyl)acetamide 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-(4-sec-butylphenyl)-2-(2-pyrimidinylsulfanyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-sec-butylphenyl)-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-(4-sec-butylphenyl)-2-(2-pyrimidinylsulfanyl)acetamide?
The CAS number of N-(4-sec-butylphenyl)-2-(2-pyrimidinylsulfanyl)acetamide is 256955-16-5.
What is the molecular formula of N-(4-sec-butylphenyl)-2-(2-pyrimidinylsulfanyl)acetamide?
The molecular formula of N-(4-sec-butylphenyl)-2-(2-pyrimidinylsulfanyl)acetamide is C16H19N3OS.
What is the molecular weight of N-(4-sec-butylphenyl)-2-(2-pyrimidinylsulfanyl)acetamide?
The molecular weight of N-(4-sec-butylphenyl)-2-(2-pyrimidinylsulfanyl)acetamide is 301.12 g/mol.
Where can I buy N-(4-sec-butylphenyl)-2-(2-pyrimidinylsulfanyl)acetamide?
You can request a quote for N-(4-sec-butylphenyl)-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-(4-sec-butylphenyl)-2-(2-pyrimidinylsulfanyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-sec-butylphenyl)-2-(2-pyrimidinylsulfanyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.