4-(2-Sulfanylphenyl)iminopentan-2-one
TL;DR: 4-(2-Sulfanylphenyl)iminopentan-2-one (CAS 28788-72-9) is a chemical compound with molecular formula C11H13NOS and molecular weight 207.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-sulfanylphenyl)iminopentan-2-one
Also Known As: 4-(2-sulfanylphenyl)iminopentan-2-one, 4-((2-mercaptophenyl)imino)pentan-2-one
| Molecular Formula | C11H13NOS |
|---|---|
| Molecular Weight | 207.07 g/mol |
| LogP | 3.0468 |
| Topological Polar Surface Area | 29.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.0718 |
| Heavy Atoms | 14 |
| Complexity | 371.3052 |
Chemical Identifiers
| CAS Number | 28788-72-9 |
|---|---|
| SMILES | CC(=NC1=CC=CC=C1S)CC(=O)C |
Product Overview
4-(2-Sulfanylphenyl)iminopentan-2-one (CAS 28788-72-9), with molecular formula C11H13NOS and molecular weight 207.07 g/mol. IUPAC: 4-(2-sulfanylphenyl)iminopentan-2-one.
Chemical Property Profile of 4-(2-Sulfanylphenyl)iminopentan-2-one
Property Insights of 4-(2-Sulfanylphenyl)iminopentan-2-one
The XLogP value of 3.0468 indicates that 4-(2-Sulfanylphenyl)iminopentan-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.43 Ų, 4-(2-Sulfanylphenyl)iminopentan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-Sulfanylphenyl)iminopentan-2-one has 1 hydrogen bond donor(s) and 3 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 4-(2-Sulfanylphenyl)iminopentan-2-one?
The CAS number of 4-(2-Sulfanylphenyl)iminopentan-2-one is 28788-72-9.
What is the molecular formula of 4-(2-Sulfanylphenyl)iminopentan-2-one?
The molecular formula of 4-(2-Sulfanylphenyl)iminopentan-2-one is C11H13NOS.
What is the molecular weight of 4-(2-Sulfanylphenyl)iminopentan-2-one?
The molecular weight of 4-(2-Sulfanylphenyl)iminopentan-2-one is 207.07 g/mol.
Where can I buy 4-(2-Sulfanylphenyl)iminopentan-2-one?
You can request a quote for 4-(2-Sulfanylphenyl)iminopentan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Sulfanylphenyl)iminopentan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Sulfanylphenyl)iminopentan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.