Rhodanine, 5-butyl-3-phenyl-
TL;DR: Rhodanine, 5-butyl-3-phenyl- (CAS 1986-32-9) is a chemical compound with molecular formula C13H15NOS2 and molecular weight 265.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-butyl-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 5-Butyl-3-phenylrhodanine, Rhodanine, 5-butyl-3-phenyl-, 5-butyl-3-phenyl-2-thioxo-1,3-thiazolidin-4-one, 5-butyl-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one, 5-Butyl-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-onato
| Molecular Formula | C13H15NOS2 |
|---|---|
| Molecular Weight | 265.06 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 77.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 265.0595 |
| Heavy Atoms | 17 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 1986-32-9 |
|---|---|
| SMILES | CCCCC1C(=O)N(C(=S)S1)C2=CC=CC=C2 |
| InChIKey | QURULMZHPAGRBE-UHFFFAOYSA-N |
Product Overview
Rhodanine, 5-butyl-3-phenyl- (CAS 1986-32-9), with molecular formula C13H15NOS2 and molecular weight 265.06 g/mol. IUPAC: 5-butyl-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of Rhodanine, 5-butyl-3-phenyl-
Property Insights of Rhodanine, 5-butyl-3-phenyl-
The XLogP value of 4.2 indicates that Rhodanine, 5-butyl-3-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Rhodanine, 5-butyl-3-phenyl-. Following Lipinski's Rule of Five, Rhodanine, 5-butyl-3-phenyl- has 0 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 Rhodanine, 5-butyl-3-phenyl-?
The CAS number of Rhodanine, 5-butyl-3-phenyl- is 1986-32-9.
What is the molecular formula of Rhodanine, 5-butyl-3-phenyl-?
The molecular formula of Rhodanine, 5-butyl-3-phenyl- is C13H15NOS2.
What is the molecular weight of Rhodanine, 5-butyl-3-phenyl-?
The molecular weight of Rhodanine, 5-butyl-3-phenyl- is 265.06 g/mol.
Where can I buy Rhodanine, 5-butyl-3-phenyl-?
You can request a quote for Rhodanine, 5-butyl-3-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rhodanine, 5-butyl-3-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for Rhodanine, 5-butyl-3-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.