5-(2-Iodophenyl)-1,3,4-oxadiazole-2(3H)-thione
TL;DR: 5-(2-Iodophenyl)-1,3,4-oxadiazole-2(3H)-thione (CAS 161013-21-4) is a chemical compound with molecular formula C8H5IN2OS and molecular weight 303.91672 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(2-iodophenyl)-3H-1,3,4-oxadiazole-2-thione
Also Known As: 5-(2-Iodophenyl)-1,3,4-oxadiazole-2(3H)-thione, 5-(2-iodophenyl)-3H-1,3,4-oxadiazole-2-thione, 5-(2-iodophenyl)-2,3-dihydro-1,3,4-oxadiazole-2-thione
Technical Specifications
| Molecular Formula | C8H5IN2OS |
| Molecular Weight | 303.91672 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 65.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 303.91672 Da |
| Heavy Atoms | 13 |
| Complexity | 257.0 |
| SMILES | C1=CC=C(C(=C1)C2=NNC(=S)O2)I |
| InChIKey | SENDEEUPCGQVLV-UHFFFAOYSA-N |
Chemical Property Profile of 5-(2-Iodophenyl)-1,3,4-oxadiazole-2(3H)-thione
Property Insights of 5-(2-Iodophenyl)-1,3,4-oxadiazole-2(3H)-thione
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-Iodophenyl)-1,3,4-oxadiazole-2(3H)-thione. The TPSA of 65.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-Iodophenyl)-1,3,4-oxadiazole-2(3H)-thione. Following Lipinski's Rule of Five, 5-(2-Iodophenyl)-1,3,4-oxadiazole-2(3H)-thione has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-(2-Iodophenyl)-1,3,4-oxadiazole-2(3H)-thione?
The CAS number of 5-(2-Iodophenyl)-1,3,4-oxadiazole-2(3H)-thione is 161013-21-4.
What is the molecular formula of 5-(2-Iodophenyl)-1,3,4-oxadiazole-2(3H)-thione?
The molecular formula of 5-(2-Iodophenyl)-1,3,4-oxadiazole-2(3H)-thione is C8H5IN2OS.
What is the molecular weight of 5-(2-Iodophenyl)-1,3,4-oxadiazole-2(3H)-thione?
The molecular weight of 5-(2-Iodophenyl)-1,3,4-oxadiazole-2(3H)-thione is 303.91672 g/mol.
Where can I buy 5-(2-Iodophenyl)-1,3,4-oxadiazole-2(3H)-thione?
You can request a quote for 5-(2-Iodophenyl)-1,3,4-oxadiazole-2(3H)-thione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(2-Iodophenyl)-1,3,4-oxadiazole-2(3H)-thione?
Yes, CoreyChem provides custom synthesis services for 5-(2-Iodophenyl)-1,3,4-oxadiazole-2(3H)-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.