Probes1_000481
TL;DR: Probes1_000481 (CAS 1261158-85-3) is a chemical compound with molecular formula C15H13Cl2NO3S2 and molecular weight 388.9714 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(5Z)-5-[(2,4-dichlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-methylbutanoic acid
Also Known As: Probes1_000481, Probes2_000421, BAS 00472999, (Z)-2-(5-(2,4-dichlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-3-methylbutanoic acid, AB00079110-01
Technical Specifications
| Molecular Formula | C15H13Cl2NO3S2 |
| Molecular Weight | 388.9714 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 115.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 388.9714 Da |
| Heavy Atoms | 23 |
| Complexity | 553.0 |
| SMILES | CC(C)C(C(=O)O)N1C(=O)/C(=C/C2=C(C=C(C=C2)Cl)Cl)/SC1=S |
| InChIKey | VJZKEKLLAISPQJ-WZUFQYTHSA-N |
Chemical Property Profile of Probes1_000481
Property Insights of Probes1_000481
The XLogP value of 5.2 indicates that Probes1_000481 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Probes1_000481. Following Lipinski's Rule of Five, Probes1_000481 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Probes1_000481?
The CAS number of Probes1_000481 is 1261158-85-3.
What is the molecular formula of Probes1_000481?
The molecular formula of Probes1_000481 is C15H13Cl2NO3S2.
What is the molecular weight of Probes1_000481?
The molecular weight of Probes1_000481 is 388.9714 g/mol.
Where can I buy Probes1_000481?
You can request a quote for Probes1_000481 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Probes1_000481?
Yes, CoreyChem provides custom synthesis services for Probes1_000481 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.