1-(tert-Butyl)-3-(4-methylthiazol-2-yl)urea
TL;DR: 1-(tert-Butyl)-3-(4-methylthiazol-2-yl)urea (CAS 697786-56-4) is a chemical compound with molecular formula C9H15N3OS and molecular weight 213.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butyl-3-(4-methyl-1,3-thiazol-2-yl)urea
Also Known As: TimTec1_002399, BAS 09079868, 1-(tert-Butyl)-3-(4-methylthiazol-2-yl)urea, 1-tert-Butyl-3-(4-methyl-thiazol-2-yl)-urea, 1-tert-butyl-3-(4-methyl-1,3-thiazol-2-yl)urea
| Molecular Formula | C9H15N3OS |
|---|---|
| Molecular Weight | 213.09 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 82.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 213.09358 |
| Heavy Atoms | 14 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 697786-56-4 |
|---|---|
| SMILES | CC1=CSC(=N1)NC(=O)NC(C)(C)C |
| InChIKey | DWPUEYMFBPIUIG-UHFFFAOYSA-N |
Product Overview
1-(tert-Butyl)-3-(4-methylthiazol-2-yl)urea (CAS 697786-56-4), with molecular formula C9H15N3OS and molecular weight 213.09 g/mol. IUPAC: 1-tert-butyl-3-(4-methyl-1,3-thiazol-2-yl)urea.
Chemical Property Profile of 1-(tert-Butyl)-3-(4-methylthiazol-2-yl)urea
Property Insights of 1-(tert-Butyl)-3-(4-methylthiazol-2-yl)urea
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(tert-Butyl)-3-(4-methylthiazol-2-yl)urea. The TPSA of 82.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(tert-Butyl)-3-(4-methylthiazol-2-yl)urea. Following Lipinski's Rule of Five, 1-(tert-Butyl)-3-(4-methylthiazol-2-yl)urea has 2 hydrogen bond donor(s) and 3 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-(4-methylthiazol-2-yl)urea?
The CAS number of 1-(tert-Butyl)-3-(4-methylthiazol-2-yl)urea is 697786-56-4.
What is the molecular formula of 1-(tert-Butyl)-3-(4-methylthiazol-2-yl)urea?
The molecular formula of 1-(tert-Butyl)-3-(4-methylthiazol-2-yl)urea is C9H15N3OS.
What is the molecular weight of 1-(tert-Butyl)-3-(4-methylthiazol-2-yl)urea?
The molecular weight of 1-(tert-Butyl)-3-(4-methylthiazol-2-yl)urea is 213.09 g/mol.
Where can I buy 1-(tert-Butyl)-3-(4-methylthiazol-2-yl)urea?
You can request a quote for 1-(tert-Butyl)-3-(4-methylthiazol-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-(tert-Butyl)-3-(4-methylthiazol-2-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(tert-Butyl)-3-(4-methylthiazol-2-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.