![3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide structure](/static/products/3318/331819-06-8.webp)
3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide
TL;DR: 3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide (CAS 331819-06-8) is a chemical compound with molecular formula C11H19N3OS and molecular weight 241.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide
Also Known As: N-(isobutyl-[1,3,4]thiadiazol-2-yl)-isovaleramide, 3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide, BAS 05023949, N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-3-methylbutanamide, N-(5-Isobutyl-[1,3,4]thiadiazol-2-yl)-3-methyl-butyramide
| Molecular Formula | C11H19N3OS |
|---|---|
| Molecular Weight | 241.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 241.12488 |
| Heavy Atoms | 16 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 331819-06-8 |
|---|---|
| SMILES | CC(C)CC1=NN=C(S1)NC(=O)CC(C)C |
| InChIKey | GFYWEGWVHUWPKP-UHFFFAOYSA-N |
Product Overview
3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide (CAS 331819-06-8), with molecular formula C11H19N3OS and molecular weight 241.12 g/mol. IUPAC: 3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide.
Chemical Property Profile of 3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide
Property Insights of 3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide. Following Lipinski's Rule of Five, 3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide 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-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide?
The CAS number of 3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide is 331819-06-8.
What is the molecular formula of 3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide?
The molecular formula of 3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide is C11H19N3OS.
What is the molecular weight of 3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide?
The molecular weight of 3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide is 241.12 g/mol.
Where can I buy 3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide?
You can request a quote for 3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.