4-(5-Amino-1,3,4-thiadiazol-2-yl)-2-methoxyphenol
TL;DR: 4-(5-Amino-1,3,4-thiadiazol-2-yl)-2-methoxyphenol (CAS 114204-62-5) is a chemical compound with molecular formula C9H9N3O2S and molecular weight 223.04155 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(5-amino-1,3,4-thiadiazol-2-yl)-2-methoxyphenol
Also Known As: 4-(5-Amino-1,3,4-thiadiazol-2-yl)-2-methoxyphenol, 2-amino-5-(4-hydroxy-3-methoxyphenyl)-1,3,4 thiadiazole, (4E)-4-(5-amino-3H-1,3,4-thiadiazol-2-ylidene)-2-methoxycyclohexa-2,5-dien-1-one, (4Z)-4-(5-amino-3H-1,3,4-thiadiazol-2-ylidene)-2-methoxycyclohexa-2,5-dien-1-one, 4-(5-amino-3H-1,3,4-thiadiazol-2-ylidene)-2-methoxy-cyclohexa-2,5-dien-1-one
Technical Specifications
| Molecular Formula | C9H9N3O2S |
| Molecular Weight | 223.04155 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 223.04155 Da |
| Heavy Atoms | 15 |
| Complexity | 220.0 |
| SMILES | COC1=C(C=CC(=C1)C2=NN=C(S2)N)O |
| InChIKey | BSPCBZUBIMXXLE-UHFFFAOYSA-N |
Chemical Property Profile of 4-(5-Amino-1,3,4-thiadiazol-2-yl)-2-methoxyphenol
Property Insights of 4-(5-Amino-1,3,4-thiadiazol-2-yl)-2-methoxyphenol
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(5-Amino-1,3,4-thiadiazol-2-yl)-2-methoxyphenol. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(5-Amino-1,3,4-thiadiazol-2-yl)-2-methoxyphenol. Following Lipinski's Rule of Five, 4-(5-Amino-1,3,4-thiadiazol-2-yl)-2-methoxyphenol has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(5-Amino-1,3,4-thiadiazol-2-yl)-2-methoxyphenol?
The CAS number of 4-(5-Amino-1,3,4-thiadiazol-2-yl)-2-methoxyphenol is 114204-62-5.
What is the molecular formula of 4-(5-Amino-1,3,4-thiadiazol-2-yl)-2-methoxyphenol?
The molecular formula of 4-(5-Amino-1,3,4-thiadiazol-2-yl)-2-methoxyphenol is C9H9N3O2S.
What is the molecular weight of 4-(5-Amino-1,3,4-thiadiazol-2-yl)-2-methoxyphenol?
The molecular weight of 4-(5-Amino-1,3,4-thiadiazol-2-yl)-2-methoxyphenol is 223.04155 g/mol.
Where can I buy 4-(5-Amino-1,3,4-thiadiazol-2-yl)-2-methoxyphenol?
You can request a quote for 4-(5-Amino-1,3,4-thiadiazol-2-yl)-2-methoxyphenol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(5-Amino-1,3,4-thiadiazol-2-yl)-2-methoxyphenol?
Yes, CoreyChem provides custom synthesis services for 4-(5-Amino-1,3,4-thiadiazol-2-yl)-2-methoxyphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.