F0876-0043
TL;DR: F0876-0043 (CAS 315695-86-4) is a chemical compound with molecular formula C25H21N5OS3 and molecular weight 503.09082 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-benzylacetamide
Also Known As: F0876-0043, 2-[5-(benzothiazol-2-ylthiomethyl)-4-phenyl(1,2,4-triazol-3-ylthio)]-N-benzyla cetamide, 2-({5-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-benzylacetamide, 2-[[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-benzylacetamide, 2-((5-((benzo[d]thiazol-2-ylthio)methyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N-benzylacetamide
Technical Specifications
| Molecular Formula | C25H21N5OS3 |
| Molecular Weight | 503.09082 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 152.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 503.09082 Da |
| Heavy Atoms | 34 |
| Complexity | 646.0 |
| SMILES | C1=CC=C(C=C1)CNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)CSC4=NC5=CC=CC=C5S4 |
| InChIKey | LHNFLZFGTWYCCM-UHFFFAOYSA-N |
Chemical Property Profile of F0876-0043
Property Insights of F0876-0043
The XLogP value of 5.6 indicates that F0876-0043 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 152.0 Ų indicates high polarity, suggesting F0876-0043 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0876-0043 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of F0876-0043?
The CAS number of F0876-0043 is 315695-86-4.
What is the molecular formula of F0876-0043?
The molecular formula of F0876-0043 is C25H21N5OS3.
What is the molecular weight of F0876-0043?
The molecular weight of F0876-0043 is 503.09082 g/mol.
Where can I buy F0876-0043?
You can request a quote for F0876-0043 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for F0876-0043?
Yes, CoreyChem provides custom synthesis services for F0876-0043 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.