N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide
TL;DR: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide (CAS 304459-45-8) is a chemical compound with molecular formula C12H13N3OS and molecular weight 247.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide
Also Known As: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide, BAS 03212496, AN-652/40076528, N-(5-Ethyl-[1,3,4]thiadiazol-2-yl)-3-methyl-benzamide
| Molecular Formula | C12H13N3OS |
|---|---|
| Molecular Weight | 247.08 g/mol |
| LogP | 2.66122 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.07793 |
| Heavy Atoms | 17 |
| Complexity | 536.05194 |
Chemical Identifiers
| CAS Number | 304459-45-8 |
|---|---|
| SMILES | CCC1=NN=C(S1)NC(=O)C2=CC=CC(=C2)C |
Product Overview
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide (CAS 304459-45-8), with molecular formula C12H13N3OS and molecular weight 247.08 g/mol. IUPAC: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide.
Chemical Property Profile of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide
Property Insights of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide
The XLogP value of 2.66122 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide. With a topological polar surface area (TPSA) of 54.88 Ų, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide 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-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide?
The CAS number of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide is 304459-45-8.
What is the molecular formula of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide?
The molecular formula of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide is C12H13N3OS.
What is the molecular weight of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide?
The molecular weight of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide is 247.08 g/mol.
Where can I buy N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide?
You can request a quote for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.