3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione
TL;DR: 3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione (CAS 80030-91-7) is a chemical compound with molecular formula C17H13NO2S and molecular weight 295.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione
Also Known As: 3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione, 2,4-Thiazolidinedione, 3-(phenylmethyl)-5-(phenylmethylene)-
| Molecular Formula | C17H13NO2S |
|---|---|
| Molecular Weight | 295.07 g/mol |
| LogP | 3.9231 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.0667 |
| Heavy Atoms | 21 |
| Complexity | 695.24475 |
Chemical Identifiers
| CAS Number | 80030-91-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=O)C(=CC3=CC=CC=C3)SC2=O |
Product Overview
3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione (CAS 80030-91-7), with molecular formula C17H13NO2S and molecular weight 295.07 g/mol. IUPAC: 3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione.
Chemical Property Profile of 3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione
Property Insights of 3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione
The XLogP value of 3.9231 indicates that 3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.38 Ų, 3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione 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 3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione?
The CAS number of 3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione is 80030-91-7.
What is the molecular formula of 3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione?
The molecular formula of 3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione is C17H13NO2S.
What is the molecular weight of 3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione?
The molecular weight of 3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione is 295.07 g/mol.
Where can I buy 3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione?
You can request a quote for 3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-benzyl-5-benzylidene-1,3-thiazolidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.