3-Aminorhodanine
TL;DR: 3-Aminorhodanine (CAS 1438-16-0) is a chemical compound with molecular formula C3H4N2OS2 and molecular weight 147.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: N-Aminorhodanine, 3-Aminorhodanine, Aminorhodanine, Rhodanine, 3-amino-, null
| Molecular Formula | C3H4N2OS2 |
|---|---|
| Molecular Weight | 147.98 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 147.9765 |
| Heavy Atoms | 8 |
| Complexity | 146.0 |
Chemical Identifiers
| CAS Number | 1438-16-0 |
|---|---|
| SMILES | C1C(=O)N(C(=S)S1)N |
| InChIKey | ZBUUHLDYMKTVLT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Aminorhodanine (CAS 1438-16-0), with molecular formula C3H4N2OS2 and molecular weight 147.98 g/mol. IUPAC: 3-amino-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of 3-Aminorhodanine
Property Insights of 3-Aminorhodanine
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Aminorhodanine. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Aminorhodanine. Following Lipinski's Rule of Five, 3-Aminorhodanine 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 3-Aminorhodanine?
The CAS number of 3-Aminorhodanine is 1438-16-0.
What is the molecular formula of 3-Aminorhodanine?
The molecular formula of 3-Aminorhodanine is C3H4N2OS2.
What is the molecular weight of 3-Aminorhodanine?
The molecular weight of 3-Aminorhodanine is 147.98 g/mol.
Where can I buy 3-Aminorhodanine?
You can request a quote for 3-Aminorhodanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Aminorhodanine?
Yes, KEHONG BIO provides custom synthesis services for 3-Aminorhodanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.