N-Benzyl-2-benzoxazolamine
TL;DR: N-Benzyl-2-benzoxazolamine (CAS 21326-87-4) is a chemical compound with molecular formula C14H12N2O and molecular weight 224.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-1,3-benzoxazol-2-amine
Also Known As: N-Benzyl-2-benzoxazolamine, N-Benzyl-1,3-benzoxazol-2-amine, 2-benzylaminobenzoxazole, 2-Benzyliminobenzoxazoline, N-benzylbenzo[d]oxazol-2-amine
| Molecular Formula | C14H12N2O |
|---|---|
| Molecular Weight | 224.09 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 38.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 224.09496 |
| Heavy Atoms | 17 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 21326-87-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC2=NC3=CC=CC=C3O2 |
| InChIKey | XHBVYWCWOQDQJP-UHFFFAOYSA-N |
Product Overview
N-Benzyl-2-benzoxazolamine (CAS 21326-87-4), with molecular formula C14H12N2O and molecular weight 224.09 g/mol. IUPAC: N-benzyl-1,3-benzoxazol-2-amine.
Chemical Property Profile of N-Benzyl-2-benzoxazolamine
Property Insights of N-Benzyl-2-benzoxazolamine
The XLogP value of 3.3 indicates that N-Benzyl-2-benzoxazolamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.1 Ų, N-Benzyl-2-benzoxazolamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Benzyl-2-benzoxazolamine 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 N-Benzyl-2-benzoxazolamine?
The CAS number of N-Benzyl-2-benzoxazolamine is 21326-87-4.
What is the molecular formula of N-Benzyl-2-benzoxazolamine?
The molecular formula of N-Benzyl-2-benzoxazolamine is C14H12N2O.
What is the molecular weight of N-Benzyl-2-benzoxazolamine?
The molecular weight of N-Benzyl-2-benzoxazolamine is 224.09 g/mol.
Where can I buy N-Benzyl-2-benzoxazolamine?
You can request a quote for N-Benzyl-2-benzoxazolamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Benzyl-2-benzoxazolamine?
Yes, KEHONG BIO provides custom synthesis services for N-Benzyl-2-benzoxazolamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.