5-(3-Pyridylmethylene)rhodanine
TL;DR: 5-(3-Pyridylmethylene)rhodanine (CAS 1784763-08-1) is a chemical compound with molecular formula C9H6N2OS2 and molecular weight 221.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-(pyridin-3-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 5-(3-Pyridylmethylene)rhodanine, Rhodanine, 5-(3-pyridylmethylene)-, (Z)-5-(pyridin-3-ylmethylene)-2-thioxothiazolidin-4-one, 2-Mercapto-5-pyridin-3-ylmethylene-thiazol-4-one, 4-27-00-07761 (Beilstein Handbook Reference)
| Molecular Formula | C9H6N2OS2 |
|---|---|
| Molecular Weight | 221.99 g/mol |
| LogP | 1.5704 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.99216 |
| Heavy Atoms | 14 |
| Complexity | 414.07996 |
Chemical Identifiers
| CAS Number | 1784763-08-1 |
|---|---|
| SMILES | C1=CC(=CN=C1)/C=C\2/C(=O)NC(=S)S2 |
Product Overview
5-(3-Pyridylmethylene)rhodanine (CAS 1784763-08-1), with molecular formula C9H6N2OS2 and molecular weight 221.99 g/mol. IUPAC: (5Z)-5-(pyridin-3-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of 5-(3-Pyridylmethylene)rhodanine
Property Insights of 5-(3-Pyridylmethylene)rhodanine
The XLogP value of 1.5704 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(3-Pyridylmethylene)rhodanine. With a topological polar surface area (TPSA) of 41.99 Ų, 5-(3-Pyridylmethylene)rhodanine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(3-Pyridylmethylene)rhodanine has 1 hydrogen bond donor(s) and 4 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 5-(3-Pyridylmethylene)rhodanine?
The CAS number of 5-(3-Pyridylmethylene)rhodanine is 1784763-08-1.
What is the molecular formula of 5-(3-Pyridylmethylene)rhodanine?
The molecular formula of 5-(3-Pyridylmethylene)rhodanine is C9H6N2OS2.
What is the molecular weight of 5-(3-Pyridylmethylene)rhodanine?
The molecular weight of 5-(3-Pyridylmethylene)rhodanine is 221.99 g/mol.
Where can I buy 5-(3-Pyridylmethylene)rhodanine?
You can request a quote for 5-(3-Pyridylmethylene)rhodanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(3-Pyridylmethylene)rhodanine?
Yes, KEHONG BIO provides custom synthesis services for 5-(3-Pyridylmethylene)rhodanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.