![4-[(5-Phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol structure](/static/products/657/6578-87-6.png)
4-[(5-Phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol
TL;DR: 4-[(5-Phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol (CAS 6578-87-6) is a chemical compound with molecular formula C15H11N3OS and molecular weight 281.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(5-phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol
Also Known As: 4-[[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]methylidene]cycloh
| Molecular Formula | C15H11N3OS |
|---|---|
| Molecular Weight | 281.06 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 86.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.0623 |
| Heavy Atoms | 20 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 6578-87-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NN=C(S2)N=CC3=CC=C(C=C3)O |
| InChIKey | FHSVRSKZUILHOR-UHFFFAOYSA-N |
Product Overview
4-[(5-Phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol (CAS 6578-87-6), with molecular formula C15H11N3OS and molecular weight 281.06 g/mol. IUPAC: 4-[(5-phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol.
Chemical Property Profile of 4-[(5-Phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol
Property Insights of 4-[(5-Phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol
The XLogP value of 3.3 indicates that 4-[(5-Phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(5-Phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol. Following Lipinski's Rule of Five, 4-[(5-Phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol 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
Frequently Asked Questions
What is the CAS number of 4-[(5-Phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol?
The CAS number of 4-[(5-Phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol is 6578-87-6.
What is the molecular formula of 4-[(5-Phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol?
The molecular formula of 4-[(5-Phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol is C15H11N3OS.
What is the molecular weight of 4-[(5-Phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol?
The molecular weight of 4-[(5-Phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol is 281.06 g/mol.
Where can I buy 4-[(5-Phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol?
You can request a quote for 4-[(5-Phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(5-Phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-[(5-Phenyl-1,3,4-thiadiazol-2-yl)iminomethyl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.