4-Benzooxazol-2-yl-benzylamine
TL;DR: 4-Benzooxazol-2-yl-benzylamine (CAS 760111-76-0) 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.
[4-(1,3-benzoxazol-2-yl)phenyl]methanamine
Also Known As: 4-Benzooxazol-2-yl-benzylamine, TimTec1_007633, BAS 08893918, [4-(1,3-benzoxazol-2-yl)phenyl]methanamine, IDI1_033287
| Molecular Formula | C14H12N2O |
|---|---|
| Molecular Weight | 224.09 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 52.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.09496 |
| Heavy Atoms | 17 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 760111-76-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)CN |
| InChIKey | XTFNBGUXOKGTDK-UHFFFAOYSA-N |
Product Overview
4-Benzooxazol-2-yl-benzylamine (CAS 760111-76-0), with molecular formula C14H12N2O and molecular weight 224.09 g/mol. IUPAC: [4-(1,3-benzoxazol-2-yl)phenyl]methanamine.
Chemical Property Profile of 4-Benzooxazol-2-yl-benzylamine
Property Insights of 4-Benzooxazol-2-yl-benzylamine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Benzooxazol-2-yl-benzylamine. With a topological polar surface area (TPSA) of 52.1 Ų, 4-Benzooxazol-2-yl-benzylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Benzooxazol-2-yl-benzylamine 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 4-Benzooxazol-2-yl-benzylamine?
The CAS number of 4-Benzooxazol-2-yl-benzylamine is 760111-76-0.
What is the molecular formula of 4-Benzooxazol-2-yl-benzylamine?
The molecular formula of 4-Benzooxazol-2-yl-benzylamine is C14H12N2O.
What is the molecular weight of 4-Benzooxazol-2-yl-benzylamine?
The molecular weight of 4-Benzooxazol-2-yl-benzylamine is 224.09 g/mol.
Where can I buy 4-Benzooxazol-2-yl-benzylamine?
You can request a quote for 4-Benzooxazol-2-yl-benzylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Benzooxazol-2-yl-benzylamine?
Yes, KEHONG BIO provides custom synthesis services for 4-Benzooxazol-2-yl-benzylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.