![1-Phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea structure](/static/products/339/339202-54-9.png)
1-Phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea
TL;DR: 1-Phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea (CAS 339202-54-9) is a chemical compound with molecular formula C12H14N4OS and molecular weight 262.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-3-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)urea
Also Known As: BAS 00830105, BIM-0007538.P001, 1-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-phenylurea, 1-phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea, N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-N'-phenylurea
| Molecular Formula | C12H14N4OS |
|---|---|
| Molecular Weight | 262.09 g/mol |
| LogP | 3.3055 |
| Topological Polar Surface Area | 66.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.08884 |
| Heavy Atoms | 18 |
| Complexity | 523.8835 |
Chemical Identifiers
| CAS Number | 339202-54-9 |
|---|---|
| SMILES | CC(C)C1=NN=C(S1)NC(=O)NC2=CC=CC=C2 |
Product Overview
1-Phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea (CAS 339202-54-9), with molecular formula C12H14N4OS and molecular weight 262.09 g/mol. IUPAC: 1-phenyl-3-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)urea.
Chemical Property Profile of 1-Phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea
Property Insights of 1-Phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea
The XLogP value of 3.3055 indicates that 1-Phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea. Following Lipinski's Rule of Five, 1-Phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea has 2 hydrogen bond donor(s) and 4 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-Phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea?
The CAS number of 1-Phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea is 339202-54-9.
What is the molecular formula of 1-Phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea?
The molecular formula of 1-Phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea is C12H14N4OS.
What is the molecular weight of 1-Phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea?
The molecular weight of 1-Phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea is 262.09 g/mol.
Where can I buy 1-Phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea?
You can request a quote for 1-Phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.