3-Phenyl-5-(2-thienylmethylene)-2-thioxo-4-imidazolidinone
TL;DR: 3-Phenyl-5-(2-thienylmethylene)-2-thioxo-4-imidazolidinone (CAS 87736-69-4) is a chemical compound with molecular formula C14H10N2OS2 and molecular weight 286.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-2-sulfanylidene-5-(thiophen-2-ylmethylidene)imidazolidin-4-one
Also Known As: 3-phenyl-5-(2-thienylmethylene)-2-thioxo-4-imidazolidinone, 3-phenyl-2-sulfanylidene-5-(thiophen-2-ylmethylidene)imidazolidin-4-one, (5E)-2-mercapto-3-phenyl-5-(2-thienylmethylene)-3,5-dihydro-4H-imidazol-4-one, 4-Imidazolidinone, 3-phenyl-5-(2-thienylmethylene)-2-thioxo-, (5Z)-3-phenyl-5-(thiophen-2-ylmethylidene)-2-thioxoimidazolidin-4-one
| Molecular Formula | C14H10N2OS2 |
|---|---|
| Molecular Weight | 286.02 g/mol |
| LogP | 3.0103 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.02347 |
| Heavy Atoms | 19 |
| Complexity | 647.3502 |
Chemical Identifiers
| CAS Number | 87736-69-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=CS3)NC2=S |
Product Overview
3-Phenyl-5-(2-thienylmethylene)-2-thioxo-4-imidazolidinone (CAS 87736-69-4), with molecular formula C14H10N2OS2 and molecular weight 286.02 g/mol. IUPAC: 3-phenyl-2-sulfanylidene-5-(thiophen-2-ylmethylidene)imidazolidin-4-one.
Chemical Property Profile of 3-Phenyl-5-(2-thienylmethylene)-2-thioxo-4-imidazolidinone
Property Insights of 3-Phenyl-5-(2-thienylmethylene)-2-thioxo-4-imidazolidinone
The XLogP value of 3.0103 indicates that 3-Phenyl-5-(2-thienylmethylene)-2-thioxo-4-imidazolidinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.34 Ų, 3-Phenyl-5-(2-thienylmethylene)-2-thioxo-4-imidazolidinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenyl-5-(2-thienylmethylene)-2-thioxo-4-imidazolidinone 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 3-Phenyl-5-(2-thienylmethylene)-2-thioxo-4-imidazolidinone?
The CAS number of 3-Phenyl-5-(2-thienylmethylene)-2-thioxo-4-imidazolidinone is 87736-69-4.
What is the molecular formula of 3-Phenyl-5-(2-thienylmethylene)-2-thioxo-4-imidazolidinone?
The molecular formula of 3-Phenyl-5-(2-thienylmethylene)-2-thioxo-4-imidazolidinone is C14H10N2OS2.
What is the molecular weight of 3-Phenyl-5-(2-thienylmethylene)-2-thioxo-4-imidazolidinone?
The molecular weight of 3-Phenyl-5-(2-thienylmethylene)-2-thioxo-4-imidazolidinone is 286.02 g/mol.
Where can I buy 3-Phenyl-5-(2-thienylmethylene)-2-thioxo-4-imidazolidinone?
You can request a quote for 3-Phenyl-5-(2-thienylmethylene)-2-thioxo-4-imidazolidinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenyl-5-(2-thienylmethylene)-2-thioxo-4-imidazolidinone?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenyl-5-(2-thienylmethylene)-2-thioxo-4-imidazolidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.