4-Imidazolidinone, 3-ethyl-1-phenyl-2-thioxo-
TL;DR: 4-Imidazolidinone, 3-ethyl-1-phenyl-2-thioxo- (CAS 5456-29-1) is a chemical compound with molecular formula C11H12N2OS and molecular weight 220.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-1-phenyl-2-sulfanylideneimidazolidin-4-one
Also Known As: 3-Ethyl-1-phenyl-2-thioxoimidazolidin-4-one, 3-ethyl-1-phenyl-2-sulfanylideneimidazolidin-4-one, 4-Imidazolidinone, 3-ethyl-1-phenyl-2-thioxo-, 3-Ethyl-1-phenyl-2-thiohydantoin, 3-Ethyl-1-phenyl-2-thioxo-imidazolidin-4-one
| Molecular Formula | C11H12N2OS |
|---|---|
| Molecular Weight | 220.07 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 55.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.06703 |
| Heavy Atoms | 15 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 5456-29-1 |
|---|---|
| SMILES | CCN1C(=O)CN(C1=S)C2=CC=CC=C2 |
| InChIKey | UYPCZQJGNPASBR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Imidazolidinone, 3-ethyl-1-phenyl-2-thioxo- (CAS 5456-29-1), with molecular formula C11H12N2OS and molecular weight 220.07 g/mol. IUPAC: 3-ethyl-1-phenyl-2-sulfanylideneimidazolidin-4-one.
Chemical Property Profile of 4-Imidazolidinone, 3-ethyl-1-phenyl-2-thioxo-
Property Insights of 4-Imidazolidinone, 3-ethyl-1-phenyl-2-thioxo-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Imidazolidinone, 3-ethyl-1-phenyl-2-thioxo-. With a topological polar surface area (TPSA) of 55.6 Ų, 4-Imidazolidinone, 3-ethyl-1-phenyl-2-thioxo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Imidazolidinone, 3-ethyl-1-phenyl-2-thioxo- has 0 hydrogen bond donor(s) and 2 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-Imidazolidinone, 3-ethyl-1-phenyl-2-thioxo-?
The CAS number of 4-Imidazolidinone, 3-ethyl-1-phenyl-2-thioxo- is 5456-29-1.
What is the molecular formula of 4-Imidazolidinone, 3-ethyl-1-phenyl-2-thioxo-?
The molecular formula of 4-Imidazolidinone, 3-ethyl-1-phenyl-2-thioxo- is C11H12N2OS.
What is the molecular weight of 4-Imidazolidinone, 3-ethyl-1-phenyl-2-thioxo-?
The molecular weight of 4-Imidazolidinone, 3-ethyl-1-phenyl-2-thioxo- is 220.07 g/mol.
Where can I buy 4-Imidazolidinone, 3-ethyl-1-phenyl-2-thioxo-?
You can request a quote for 4-Imidazolidinone, 3-ethyl-1-phenyl-2-thioxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Imidazolidinone, 3-ethyl-1-phenyl-2-thioxo-?
Yes, KEHONG BIO provides custom synthesis services for 4-Imidazolidinone, 3-ethyl-1-phenyl-2-thioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.