3-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide
TL;DR: 3-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide (CAS 540522-12-1) is a chemical compound with molecular formula C12H11N3O2S and molecular weight 261.0572 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide
Also Known As: 3-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)acrylamide, 3-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide
Technical Specifications
| Molecular Formula | C12H11N3O2S |
| Molecular Weight | 261.0572 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 92.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.0572 Da |
| Heavy Atoms | 18 |
| Complexity | 304.0 |
| SMILES | COC1=CC=C(C=C1)C=CC(=O)NC2=NN=CS2 |
| InChIKey | PJNPZJNPLYLZKJ-UHFFFAOYSA-N |
Chemical Property Profile of 3-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide
Property Insights of 3-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide. Following Lipinski's Rule of Five, 3-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide has 1 hydrogen bond donor(s) and 5 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-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide?
The CAS number of 3-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide is 540522-12-1.
What is the molecular formula of 3-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide?
The molecular formula of 3-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide is C12H11N3O2S.
What is the molecular weight of 3-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide?
The molecular weight of 3-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide is 261.0572 g/mol.
Where can I buy 3-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide?
You can request a quote for 3-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide?
Yes, CoreyChem provides custom synthesis services for 3-(4-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.