![1-Tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea structure](/static/products/898/898120-20-2.png)
1-Tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea
TL;DR: 1-Tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea (CAS 898120-20-2) is a chemical compound with molecular formula C14H17ClN4O2 and molecular weight 308.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea
Also Known As: 1-tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea, 1-tert-butyl-3-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}urea, 1-(tert-butyl)-3-((3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl)methyl)urea
| Molecular Formula | C14H17ClN4O2 |
|---|---|
| Molecular Weight | 308.10 g/mol |
| LogP | 2.9877 |
| Topological Polar Surface Area | 80.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.104 |
| Heavy Atoms | 21 |
| Complexity | 616.6494 |
Chemical Identifiers
| CAS Number | 898120-20-2 |
|---|---|
| SMILES | CC(C)(C)NC(=O)NCC1=NC(=NO1)C2=CC=C(C=C2)Cl |
Product Overview
1-Tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea (CAS 898120-20-2), with molecular formula C14H17ClN4O2 and molecular weight 308.10 g/mol. IUPAC: 1-tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea.
Chemical Property Profile of 1-Tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea
Property Insights of 1-Tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea
The XLogP value of 2.9877 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea. The TPSA of 80.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea. Following Lipinski's Rule of Five, 1-Tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]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-Tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea?
The CAS number of 1-Tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea is 898120-20-2.
What is the molecular formula of 1-Tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea?
The molecular formula of 1-Tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea is C14H17ClN4O2.
What is the molecular weight of 1-Tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea?
The molecular weight of 1-Tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea is 308.10 g/mol.
Where can I buy 1-Tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea?
You can request a quote for 1-Tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-Tert-butyl-3-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.