2-(Isobutylamino)benzoxazole
TL;DR: 2-(Isobutylamino)benzoxazole (CAS 28291-83-0) is a chemical compound with molecular formula C11H14N2O and molecular weight 190.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methylpropyl)-1,3-benzoxazol-2-amine
Also Known As: 2-(ISOBUTYLAMINO)BENZOXAZOLE, N-Isobutyl-2-benzoxazolamine, Benzoxazole, 2-(isobutylamino)-, n-isobutylbenzo[d]oxazol-2-amine, N-(2-methylpropyl)-1,3-benzoxazol-2-amine
| Molecular Formula | C11H14N2O |
|---|---|
| Molecular Weight | 190.11 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 38.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 190.11061 |
| Heavy Atoms | 14 |
| Complexity | 184.0 |
Chemical Identifiers
| CAS Number | 28291-83-0 |
|---|---|
| SMILES | CC(C)CNC1=NC2=CC=CC=C2O1 |
| InChIKey | PHLFWHZVWXINAD-UHFFFAOYSA-N |
Product Overview
2-(Isobutylamino)benzoxazole (CAS 28291-83-0), with molecular formula C11H14N2O and molecular weight 190.11 g/mol. IUPAC: N-(2-methylpropyl)-1,3-benzoxazol-2-amine.
Chemical Property Profile of 2-(Isobutylamino)benzoxazole
Property Insights of 2-(Isobutylamino)benzoxazole
The XLogP value of 3.2 indicates that 2-(Isobutylamino)benzoxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.1 Ų, 2-(Isobutylamino)benzoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Isobutylamino)benzoxazole has 1 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 2-(Isobutylamino)benzoxazole?
The CAS number of 2-(Isobutylamino)benzoxazole is 28291-83-0.
What is the molecular formula of 2-(Isobutylamino)benzoxazole?
The molecular formula of 2-(Isobutylamino)benzoxazole is C11H14N2O.
What is the molecular weight of 2-(Isobutylamino)benzoxazole?
The molecular weight of 2-(Isobutylamino)benzoxazole is 190.11 g/mol.
Where can I buy 2-(Isobutylamino)benzoxazole?
You can request a quote for 2-(Isobutylamino)benzoxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Isobutylamino)benzoxazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(Isobutylamino)benzoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.