(5E)-2-mercapto-3-phenyl-5-(pyridin-3-ylmethylene)-3,5-dihydro-4H-imidazol-4-one
TL;DR: (5E)-2-mercapto-3-phenyl-5-(pyridin-3-ylmethylene)-3,5-dihydro-4H-imidazol-4-one (CAS 145693-90-9) is a chemical compound with molecular formula C15H11N3OS and molecular weight 281.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-5-(pyridin-3-ylmethylidene)-2-sulfanylideneimidazolidin-4-one
Also Known As: (5E)-2-mercapto-3-phenyl-5-(pyridin-3-ylmethylene)-3,5-dihydro-4H-imidazol-4-one, 3-phenyl-5-(pyridin-3-ylmethylidene)-2-sulfanylideneimidazolidin-4-one, (5E)-3-phenyl-5-(pyridin-3-ylmethylidene)-2-sulfanylideneimidazolidin-4-one
| Molecular Formula | C15H11N3OS |
|---|---|
| Molecular Weight | 281.06 g/mol |
| LogP | 2.3438 |
| Topological Polar Surface Area | 45.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.0623 |
| Heavy Atoms | 20 |
| Complexity | 682.77954 |
Chemical Identifiers
| CAS Number | 145693-90-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)C(=CC3=CN=CC=C3)NC2=S |
Product Overview
(5E)-2-mercapto-3-phenyl-5-(pyridin-3-ylmethylene)-3,5-dihydro-4H-imidazol-4-one (CAS 145693-90-9), with molecular formula C15H11N3OS and molecular weight 281.06 g/mol. IUPAC: 3-phenyl-5-(pyridin-3-ylmethylidene)-2-sulfanylideneimidazolidin-4-one.
Chemical Property Profile of (5E)-2-mercapto-3-phenyl-5-(pyridin-3-ylmethylene)-3,5-dihydro-4H-imidazol-4-one
Property Insights of (5E)-2-mercapto-3-phenyl-5-(pyridin-3-ylmethylene)-3,5-dihydro-4H-imidazol-4-one
The XLogP value of 2.3438 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5E)-2-mercapto-3-phenyl-5-(pyridin-3-ylmethylene)-3,5-dihydro-4H-imidazol-4-one. With a topological polar surface area (TPSA) of 45.23 Ų, (5E)-2-mercapto-3-phenyl-5-(pyridin-3-ylmethylene)-3,5-dihydro-4H-imidazol-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5E)-2-mercapto-3-phenyl-5-(pyridin-3-ylmethylene)-3,5-dihydro-4H-imidazol-4-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 (5E)-2-mercapto-3-phenyl-5-(pyridin-3-ylmethylene)-3,5-dihydro-4H-imidazol-4-one?
The CAS number of (5E)-2-mercapto-3-phenyl-5-(pyridin-3-ylmethylene)-3,5-dihydro-4H-imidazol-4-one is 145693-90-9.
What is the molecular formula of (5E)-2-mercapto-3-phenyl-5-(pyridin-3-ylmethylene)-3,5-dihydro-4H-imidazol-4-one?
The molecular formula of (5E)-2-mercapto-3-phenyl-5-(pyridin-3-ylmethylene)-3,5-dihydro-4H-imidazol-4-one is C15H11N3OS.
What is the molecular weight of (5E)-2-mercapto-3-phenyl-5-(pyridin-3-ylmethylene)-3,5-dihydro-4H-imidazol-4-one?
The molecular weight of (5E)-2-mercapto-3-phenyl-5-(pyridin-3-ylmethylene)-3,5-dihydro-4H-imidazol-4-one is 281.06 g/mol.
Where can I buy (5E)-2-mercapto-3-phenyl-5-(pyridin-3-ylmethylene)-3,5-dihydro-4H-imidazol-4-one?
You can request a quote for (5E)-2-mercapto-3-phenyl-5-(pyridin-3-ylmethylene)-3,5-dihydro-4H-imidazol-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5E)-2-mercapto-3-phenyl-5-(pyridin-3-ylmethylene)-3,5-dihydro-4H-imidazol-4-one?
Yes, KEHONG BIO provides custom synthesis services for (5E)-2-mercapto-3-phenyl-5-(pyridin-3-ylmethylene)-3,5-dihydro-4H-imidazol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.