2-(4-Aminophenyl)-1,3-benzoxazol-6-amine
TL;DR: 2-(4-Aminophenyl)-1,3-benzoxazol-6-amine (CAS 1104483-92-2) is a chemical compound with molecular formula C13H11N3O and molecular weight 225.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-aminophenyl)-1,3-benzoxazol-6-amine
Also Known As: 2-(4-Aminophenyl)benzo[d]oxazol-6-amine, 2-(4-Aminophenyl)-1,3-benzoxazol-6-amine, 6-Amino-2-(4-aminophenyl)benzoxazole, 2-(4-aminophenyl)-6-aminobenzoxazole, 2-(4-Amino-phenyl)-benzooxazol-6-ylamine
| Molecular Formula | C13H11N3O |
|---|---|
| Molecular Weight | 225.09 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 225.09021 |
| Heavy Atoms | 17 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 1104483-92-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NC3=C(O2)C=C(C=C3)N)N |
| InChIKey | IBKFNGCWUPNUHY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Aminophenyl)-1,3-benzoxazol-6-amine (CAS 1104483-92-2), with molecular formula C13H11N3O and molecular weight 225.09 g/mol. IUPAC: 2-(4-aminophenyl)-1,3-benzoxazol-6-amine.
Chemical Property Profile of 2-(4-Aminophenyl)-1,3-benzoxazol-6-amine
Property Insights of 2-(4-Aminophenyl)-1,3-benzoxazol-6-amine
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Aminophenyl)-1,3-benzoxazol-6-amine. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Aminophenyl)-1,3-benzoxazol-6-amine. Following Lipinski's Rule of Five, 2-(4-Aminophenyl)-1,3-benzoxazol-6-amine has 2 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 2-(4-Aminophenyl)-1,3-benzoxazol-6-amine?
The CAS number of 2-(4-Aminophenyl)-1,3-benzoxazol-6-amine is 1104483-92-2.
What is the molecular formula of 2-(4-Aminophenyl)-1,3-benzoxazol-6-amine?
The molecular formula of 2-(4-Aminophenyl)-1,3-benzoxazol-6-amine is C13H11N3O.
What is the molecular weight of 2-(4-Aminophenyl)-1,3-benzoxazol-6-amine?
The molecular weight of 2-(4-Aminophenyl)-1,3-benzoxazol-6-amine is 225.09 g/mol.
Where can I buy 2-(4-Aminophenyl)-1,3-benzoxazol-6-amine?
You can request a quote for 2-(4-Aminophenyl)-1,3-benzoxazol-6-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Aminophenyl)-1,3-benzoxazol-6-amine?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Aminophenyl)-1,3-benzoxazol-6-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.