Urea, N-(5-(2-hydroxy-1,1-dimethylethyl)-3-isoxazolyl)-N'-methyl-
TL;DR: Urea, N-(5-(2-hydroxy-1,1-dimethylethyl)-3-isoxazolyl)-N'-methyl- (CAS 81202-19-9) is a chemical compound with molecular formula C9H15N3O3 and molecular weight 213.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-3-methylurea
Also Known As: Urea, N-(5-(2-hydroxy-1,1-dimethylethyl)-3-isoxazolyl)-N'-methyl-, 1-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-3-methylurea, 1-Methyl-3-[5-(1,1-dimethyl-2-hydroxyethyl)-3-isoxazolyl]urea, 3-[5-(1,1-dimethyl-2-hydroxyethyl)-3-isoxazolyl]-1-methylurea, N-[5-(1-Hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-N'-methylurea
| Molecular Formula | C9H15N3O3 |
|---|---|
| Molecular Weight | 213.11 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 87.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 213.11134 |
| Heavy Atoms | 15 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 81202-19-9 |
|---|---|
| SMILES | CC(C)(CO)C1=CC(=NO1)NC(=O)NC |
| InChIKey | JTAVKYCLNHBTPU-UHFFFAOYSA-N |
Product Overview
Urea, N-(5-(2-hydroxy-1,1-dimethylethyl)-3-isoxazolyl)-N'-methyl- (CAS 81202-19-9), with molecular formula C9H15N3O3 and molecular weight 213.11 g/mol. IUPAC: 1-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-3-methylurea.
Chemical Property Profile of Urea, N-(5-(2-hydroxy-1,1-dimethylethyl)-3-isoxazolyl)-N'-methyl-
Property Insights of Urea, N-(5-(2-hydroxy-1,1-dimethylethyl)-3-isoxazolyl)-N'-methyl-
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, N-(5-(2-hydroxy-1,1-dimethylethyl)-3-isoxazolyl)-N'-methyl-. The TPSA of 87.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, N-(5-(2-hydroxy-1,1-dimethylethyl)-3-isoxazolyl)-N'-methyl-. Following Lipinski's Rule of Five, Urea, N-(5-(2-hydroxy-1,1-dimethylethyl)-3-isoxazolyl)-N'-methyl- has 3 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 Urea, N-(5-(2-hydroxy-1,1-dimethylethyl)-3-isoxazolyl)-N'-methyl-?
The CAS number of Urea, N-(5-(2-hydroxy-1,1-dimethylethyl)-3-isoxazolyl)-N'-methyl- is 81202-19-9.
What is the molecular formula of Urea, N-(5-(2-hydroxy-1,1-dimethylethyl)-3-isoxazolyl)-N'-methyl-?
The molecular formula of Urea, N-(5-(2-hydroxy-1,1-dimethylethyl)-3-isoxazolyl)-N'-methyl- is C9H15N3O3.
What is the molecular weight of Urea, N-(5-(2-hydroxy-1,1-dimethylethyl)-3-isoxazolyl)-N'-methyl-?
The molecular weight of Urea, N-(5-(2-hydroxy-1,1-dimethylethyl)-3-isoxazolyl)-N'-methyl- is 213.11 g/mol.
Where can I buy Urea, N-(5-(2-hydroxy-1,1-dimethylethyl)-3-isoxazolyl)-N'-methyl-?
You can request a quote for Urea, N-(5-(2-hydroxy-1,1-dimethylethyl)-3-isoxazolyl)-N'-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, N-(5-(2-hydroxy-1,1-dimethylethyl)-3-isoxazolyl)-N'-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Urea, N-(5-(2-hydroxy-1,1-dimethylethyl)-3-isoxazolyl)-N'-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.