N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide
TL;DR: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide (CAS 312927-51-8) is a chemical compound with molecular formula C13H14IN3OS and molecular weight 386.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide
Also Known As: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide, BAS 00321845, N-(5-tert-Butyl-[1,3,4]thiadiazol-2-yl)-2-iodo-benzamide, N-[5-(1,1-dimethylethyl)-1,3,4-thiadiazol-2-yl]-2-iodobenzamide
| Molecular Formula | C13H14IN3OS |
|---|---|
| Molecular Weight | 386.99 g/mol |
| LogP | 3.6925 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 386.99023 |
| Heavy Atoms | 19 |
| Complexity | 603.93097 |
Chemical Identifiers
| CAS Number | 312927-51-8 |
|---|---|
| SMILES | CC(C)(C)C1=NN=C(S1)NC(=O)C2=CC=CC=C2I |
Product Overview
N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide (CAS 312927-51-8), with molecular formula C13H14IN3OS and molecular weight 386.99 g/mol. IUPAC: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide.
Chemical Property Profile of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide
Property Insights of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide
The XLogP value of 3.6925 indicates that N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide has 1 hydrogen bond donor(s) and 4 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 N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide?
The CAS number of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide is 312927-51-8.
What is the molecular formula of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide?
The molecular formula of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide is C13H14IN3OS.
What is the molecular weight of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide?
The molecular weight of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide is 386.99 g/mol.
Where can I buy N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide?
You can request a quote for N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-iodobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.