3-Chloro-n-1,3,4-thiadiazol-2-ylpropanamide
TL;DR: 3-Chloro-n-1,3,4-thiadiazol-2-ylpropanamide (CAS 161354-54-7) is a chemical compound with molecular formula C5H6ClN3OS and molecular weight 190.992 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-chloro-N-(1,3,4-thiadiazol-2-yl)propanamide
Also Known As: 3-chloro-N-(1,3,4-thiadiazol-2-yl)propanamide, 3-chloro-n-1,3,4-thiadiazol-2-ylpropanamide
Technical Specifications
| Molecular Formula | C5H6ClN3OS |
| Molecular Weight | 190.992 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 190.992 Da |
| Heavy Atoms | 11 |
| Complexity | 146.0 |
| SMILES | C1=NN=C(S1)NC(=O)CCCl |
| InChIKey | TXYFKHUHTIYUCH-UHFFFAOYSA-N |
Chemical Property Profile of 3-Chloro-n-1,3,4-thiadiazol-2-ylpropanamide
Property Insights of 3-Chloro-n-1,3,4-thiadiazol-2-ylpropanamide
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-n-1,3,4-thiadiazol-2-ylpropanamide. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Chloro-n-1,3,4-thiadiazol-2-ylpropanamide. Following Lipinski's Rule of Five, 3-Chloro-n-1,3,4-thiadiazol-2-ylpropanamide 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
What is the CAS number of 3-Chloro-n-1,3,4-thiadiazol-2-ylpropanamide?
The CAS number of 3-Chloro-n-1,3,4-thiadiazol-2-ylpropanamide is 161354-54-7.
What is the molecular formula of 3-Chloro-n-1,3,4-thiadiazol-2-ylpropanamide?
The molecular formula of 3-Chloro-n-1,3,4-thiadiazol-2-ylpropanamide is C5H6ClN3OS.
What is the molecular weight of 3-Chloro-n-1,3,4-thiadiazol-2-ylpropanamide?
The molecular weight of 3-Chloro-n-1,3,4-thiadiazol-2-ylpropanamide is 190.992 g/mol.
Where can I buy 3-Chloro-n-1,3,4-thiadiazol-2-ylpropanamide?
You can request a quote for 3-Chloro-n-1,3,4-thiadiazol-2-ylpropanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Chloro-n-1,3,4-thiadiazol-2-ylpropanamide?
Yes, CoreyChem provides custom synthesis services for 3-Chloro-n-1,3,4-thiadiazol-2-ylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.