2-Benzoxazolamine, n-butyl-
TL;DR: 2-Benzoxazolamine, n-butyl- (CAS 21326-84-1) 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-butyl-1,3-benzoxazol-2-amine
Also Known As: 2-Benzoxazolamine, n-butyl-, n-Butyl-1,3-benzoxazol-2-amine, 2-Butylaminobenzoxazole, 2-butylamino-benzoxazole, N-Butyl-2-benzoxazolamine
| Molecular Formula | C11H14N2O |
|---|---|
| Molecular Weight | 190.11 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 38.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 190.11061 |
| Heavy Atoms | 14 |
| Complexity | 175.0 |
Chemical Identifiers
| CAS Number | 21326-84-1 |
|---|---|
| SMILES | CCCCNC1=NC2=CC=CC=C2O1 |
| InChIKey | GBLFFIRDYCSZSX-UHFFFAOYSA-N |
Product Overview
2-Benzoxazolamine, n-butyl- (CAS 21326-84-1), with molecular formula C11H14N2O and molecular weight 190.11 g/mol. IUPAC: N-butyl-1,3-benzoxazol-2-amine.
Chemical Property Profile of 2-Benzoxazolamine, n-butyl-
Property Insights of 2-Benzoxazolamine, n-butyl-
The XLogP value of 3.1 indicates that 2-Benzoxazolamine, n-butyl- 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-Benzoxazolamine, n-butyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzoxazolamine, n-butyl- 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-Benzoxazolamine, n-butyl-?
The CAS number of 2-Benzoxazolamine, n-butyl- is 21326-84-1.
What is the molecular formula of 2-Benzoxazolamine, n-butyl-?
The molecular formula of 2-Benzoxazolamine, n-butyl- is C11H14N2O.
What is the molecular weight of 2-Benzoxazolamine, n-butyl-?
The molecular weight of 2-Benzoxazolamine, n-butyl- is 190.11 g/mol.
Where can I buy 2-Benzoxazolamine, n-butyl-?
You can request a quote for 2-Benzoxazolamine, n-butyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzoxazolamine, n-butyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzoxazolamine, n-butyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.