Rhodanine, 3-benzyl-5-(p-chlorobenzylidene)-
TL;DR: Rhodanine, 3-benzyl-5-(p-chlorobenzylidene)- (CAS 5144-76-3) is a chemical compound with molecular formula C17H12ClNOS2 and molecular weight 345.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-3-benzyl-5-[(4-chlorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 3-Benzyl-5-(p-chlorobenzylidene)rhodanine, Rhodanine, 3-benzyl-5-(p-chlorobenzylidene)-, 3-Benzyl-5-(4-chloro-benzylidene)-2-thioxo-thiazolidin-4-one, 3-Benzyl-5-(4-chlorobenzylidene)-2-thioxothiazolidin-4-one, 3-benzyl-5-(4-chlorobenzylidene)-2-thioxo-1,3-thiazolidin-4-one
| Molecular Formula | C17H12ClNOS2 |
|---|---|
| Molecular Weight | 345.00 g/mol |
| LogP | 4.7414 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 345.00488 |
| Heavy Atoms | 22 |
| Complexity | 741.0141 |
Chemical Identifiers
| CAS Number | 5144-76-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=O)/C(=C\C3=CC=C(C=C3)Cl)/SC2=S |
Product Overview
Rhodanine, 3-benzyl-5-(p-chlorobenzylidene)- (CAS 5144-76-3), with molecular formula C17H12ClNOS2 and molecular weight 345.00 g/mol. IUPAC: (5E)-3-benzyl-5-[(4-chlorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of Rhodanine, 3-benzyl-5-(p-chlorobenzylidene)-
Property Insights of Rhodanine, 3-benzyl-5-(p-chlorobenzylidene)-
The XLogP value of 4.7414 indicates that Rhodanine, 3-benzyl-5-(p-chlorobenzylidene)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, Rhodanine, 3-benzyl-5-(p-chlorobenzylidene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Rhodanine, 3-benzyl-5-(p-chlorobenzylidene)- 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, 3-benzyl-5-(p-chlorobenzylidene)-?
The CAS number of Rhodanine, 3-benzyl-5-(p-chlorobenzylidene)- is 5144-76-3.
What is the molecular formula of Rhodanine, 3-benzyl-5-(p-chlorobenzylidene)-?
The molecular formula of Rhodanine, 3-benzyl-5-(p-chlorobenzylidene)- is C17H12ClNOS2.
What is the molecular weight of Rhodanine, 3-benzyl-5-(p-chlorobenzylidene)-?
The molecular weight of Rhodanine, 3-benzyl-5-(p-chlorobenzylidene)- is 345.00 g/mol.
Where can I buy Rhodanine, 3-benzyl-5-(p-chlorobenzylidene)-?
You can request a quote for Rhodanine, 3-benzyl-5-(p-chlorobenzylidene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rhodanine, 3-benzyl-5-(p-chlorobenzylidene)-?
Yes, KEHONG BIO provides custom synthesis services for Rhodanine, 3-benzyl-5-(p-chlorobenzylidene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.