C13H12Fnos2
TL;DR: C13H12Fnos2 (CAS 324560-82-9) is a chemical compound with molecular formula C13H12FNOS2 and molecular weight 281.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(4-fluorophenyl)methylidene]-3-propan-2-yl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: (Z)-5-(4-fluorobenzylidene)-3-isopropyl-2-thioxothiazolidin-4-one, (5Z)-5-[(4-fluorophenyl)methylidene]-3-propan-2-yl-2-sulfanylidene-1,3-thiazolidin-4-one, 5-[(4-FLUOROPHENYL)METHYLENE]-3-ISOPROPYL-2-THIOXO-1,3-THIAZOLAN-4-ONE, C13H12FNOS2
| Molecular Formula | C13H12FNOS2 |
|---|---|
| Molecular Weight | 281.03 g/mol |
| LogP | 3.4353 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.03442 |
| Heavy Atoms | 18 |
| Complexity | 522.2977 |
Chemical Identifiers
| CAS Number | 324560-82-9 |
|---|---|
| SMILES | CC(C)N1C(=O)/C(=C/C2=CC=C(C=C2)F)/SC1=S |
Product Overview
C13H12Fnos2 (CAS 324560-82-9), with molecular formula C13H12FNOS2 and molecular weight 281.03 g/mol. IUPAC: (5Z)-5-[(4-fluorophenyl)methylidene]-3-propan-2-yl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of C13H12Fnos2
Property Insights of C13H12Fnos2
The XLogP value of 3.4353 indicates that C13H12Fnos2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, C13H12Fnos2 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C13H12Fnos2 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 C13H12Fnos2?
The CAS number of C13H12Fnos2 is 324560-82-9.
What is the molecular formula of C13H12Fnos2?
The molecular formula of C13H12Fnos2 is C13H12FNOS2.
What is the molecular weight of C13H12Fnos2?
The molecular weight of C13H12Fnos2 is 281.03 g/mol.
Where can I buy C13H12Fnos2?
You can request a quote for C13H12Fnos2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C13H12Fnos2?
Yes, KEHONG BIO provides custom synthesis services for C13H12Fnos2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.