3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide
TL;DR: 3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide (CAS 313648-41-8) is a chemical compound with molecular formula C11H10BrN3OS and molecular weight 310.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide
Also Known As: 3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide, (3-bromophenyl)-N-(5-ethyl(1,3,4-thiadiazol-2-yl))carboxamide, 3-bromo-N-[(2E)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
| Molecular Formula | C11H10BrN3OS |
|---|---|
| Molecular Weight | 310.97 g/mol |
| LogP | 3.1153 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 310.9728 |
| Heavy Atoms | 17 |
| Complexity | 541.01776 |
Chemical Identifiers
| CAS Number | 313648-41-8 |
|---|---|
| SMILES | CCC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)Br |
Product Overview
3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide (CAS 313648-41-8), with molecular formula C11H10BrN3OS and molecular weight 310.97 g/mol. IUPAC: 3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide.
Chemical Property Profile of 3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide
Property Insights of 3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide
The XLogP value of 3.1153 indicates that 3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, 3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide 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 3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide?
The CAS number of 3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide is 313648-41-8.
What is the molecular formula of 3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide?
The molecular formula of 3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide is C11H10BrN3OS.
What is the molecular weight of 3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide?
The molecular weight of 3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide is 310.97 g/mol.
Where can I buy 3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide?
You can request a quote for 3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-bromo-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.