N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide
TL;DR: N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide (CAS 311787-52-7) is a chemical compound with molecular formula C7H9N3OS and molecular weight 183.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide
Also Known As: BAS 05668266, N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide, (E)-N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide
| Molecular Formula | C7H9N3OS |
|---|---|
| Molecular Weight | 183.05 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 183.04663 |
| Heavy Atoms | 12 |
| Complexity | 195.0 |
Chemical Identifiers
| CAS Number | 311787-52-7 |
|---|---|
| SMILES | CC=CC(=O)NC1=NN=C(S1)C |
| InChIKey | SZTDNCRGNFYPOT-UHFFFAOYSA-N |
Product Overview
N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide (CAS 311787-52-7), with molecular formula C7H9N3OS and molecular weight 183.05 g/mol. IUPAC: N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide.
Chemical Property Profile of N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide
Property Insights of N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide. Following Lipinski's Rule of Five, N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide 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-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide?
The CAS number of N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide is 311787-52-7.
What is the molecular formula of N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide?
The molecular formula of N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide is C7H9N3OS.
What is the molecular weight of N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide?
The molecular weight of N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide is 183.05 g/mol.
Where can I buy N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide?
You can request a quote for N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-methyl-1,3,4-thiadiazol-2-yl)but-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.