1-(4-Methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone
TL;DR: 1-(4-Methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone (CAS 125488-05-3) is a chemical compound with molecular formula C12H12N2O2S and molecular weight 248.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone
Also Known As: 1-(4-methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone, J2.534.004C, AQ-349/42302538, 4 -Methoxy-alpha-(5-methyl-1,3,4-thiadiazole-2-yl)acetophenone, 1-(4-methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethan-1-one
| Molecular Formula | C12H12N2O2S |
|---|---|
| Molecular Weight | 248.06 g/mol |
| LogP | 2.28052 |
| Topological Polar Surface Area | 52.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 248.06195 |
| Heavy Atoms | 17 |
| Complexity | 519.5568 |
Chemical Identifiers
| CAS Number | 125488-05-3 |
|---|---|
| SMILES | CC1=NN=C(S1)CC(=O)C2=CC=C(C=C2)OC |
Product Overview
1-(4-Methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone (CAS 125488-05-3), with molecular formula C12H12N2O2S and molecular weight 248.06 g/mol. IUPAC: 1-(4-methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone.
Chemical Property Profile of 1-(4-Methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone
Property Insights of 1-(4-Methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone
The XLogP value of 2.28052 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone. With a topological polar surface area (TPSA) of 52.08 Ų, 1-(4-Methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone has 0 hydrogen bond donor(s) and 5 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 1-(4-Methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone?
The CAS number of 1-(4-Methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone is 125488-05-3.
What is the molecular formula of 1-(4-Methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone?
The molecular formula of 1-(4-Methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone is C12H12N2O2S.
What is the molecular weight of 1-(4-Methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone?
The molecular weight of 1-(4-Methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone is 248.06 g/mol.
Where can I buy 1-(4-Methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone?
You can request a quote for 1-(4-Methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methoxyphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.