3-Phenyl-5-(pyridin-3-ylmethylidene)-2-thioxoimidazolidin-4-one
TL;DR: 3-Phenyl-5-(pyridin-3-ylmethylidene)-2-thioxoimidazolidin-4-one (CAS 874755-85-8) 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.
(5Z)-3-phenyl-5-(pyridin-3-ylmethylidene)-2-sulfanylideneimidazolidin-4-one
Also Known As: 3-Phenyl-5-(pyridin-3-ylmethylidene)-2-thioxoimidazolidin-4-one, (Z)-3-phenyl-5-(pyridin-3-ylmethylene)-2-thioxoimidazolidin-4-one, 3-phenyl-5-(3-pyridylmethylene)-2-thioxo-1,3-diazolidin-4-one, (5Z)-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 | 874755-85-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)/C(=C/C3=CN=CC=C3)/NC2=S |
Product Overview
3-Phenyl-5-(pyridin-3-ylmethylidene)-2-thioxoimidazolidin-4-one (CAS 874755-85-8), with molecular formula C15H11N3OS and molecular weight 281.06 g/mol. IUPAC: (5Z)-3-phenyl-5-(pyridin-3-ylmethylidene)-2-sulfanylideneimidazolidin-4-one.
Chemical Property Profile of 3-Phenyl-5-(pyridin-3-ylmethylidene)-2-thioxoimidazolidin-4-one
Property Insights of 3-Phenyl-5-(pyridin-3-ylmethylidene)-2-thioxoimidazolidin-4-one
The XLogP value of 2.3438 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Phenyl-5-(pyridin-3-ylmethylidene)-2-thioxoimidazolidin-4-one. With a topological polar surface area (TPSA) of 45.23 Ų, 3-Phenyl-5-(pyridin-3-ylmethylidene)-2-thioxoimidazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenyl-5-(pyridin-3-ylmethylidene)-2-thioxoimidazolidin-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 3-Phenyl-5-(pyridin-3-ylmethylidene)-2-thioxoimidazolidin-4-one?
The CAS number of 3-Phenyl-5-(pyridin-3-ylmethylidene)-2-thioxoimidazolidin-4-one is 874755-85-8.
What is the molecular formula of 3-Phenyl-5-(pyridin-3-ylmethylidene)-2-thioxoimidazolidin-4-one?
The molecular formula of 3-Phenyl-5-(pyridin-3-ylmethylidene)-2-thioxoimidazolidin-4-one is C15H11N3OS.
What is the molecular weight of 3-Phenyl-5-(pyridin-3-ylmethylidene)-2-thioxoimidazolidin-4-one?
The molecular weight of 3-Phenyl-5-(pyridin-3-ylmethylidene)-2-thioxoimidazolidin-4-one is 281.06 g/mol.
Where can I buy 3-Phenyl-5-(pyridin-3-ylmethylidene)-2-thioxoimidazolidin-4-one?
You can request a quote for 3-Phenyl-5-(pyridin-3-ylmethylidene)-2-thioxoimidazolidin-4-one 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-(pyridin-3-ylmethylidene)-2-thioxoimidazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenyl-5-(pyridin-3-ylmethylidene)-2-thioxoimidazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.