4-(5-Amino-benzooxazol-2-YL)-phenol
TL;DR: 4-(5-Amino-benzooxazol-2-YL)-phenol (CAS 54995-54-9) is a chemical compound with molecular formula C13H10N2O2 and molecular weight 226.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(5-amino-1,3-benzoxazol-2-yl)phenol
Also Known As: AKOS BB-8620, 4-(5-aminobenzooxazol-2-yl)phenol, 4-(5-AMINO-BENZOOXAZOL-2-YL)-PHENOL, 4-(5-aminobenzo[d]oxazol-2-yl)phenol, 4-(5-amino-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,5-dien-1-one
| Molecular Formula | C13H10N2O2 |
|---|---|
| Molecular Weight | 226.07 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 72.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 226.07423 |
| Heavy Atoms | 17 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 54995-54-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NC3=C(O2)C=CC(=C3)N)O |
| InChIKey | SLGCWIKPPYGYJC-UHFFFAOYSA-N |
Product Overview
4-(5-Amino-benzooxazol-2-YL)-phenol (CAS 54995-54-9), with molecular formula C13H10N2O2 and molecular weight 226.07 g/mol. IUPAC: 4-(5-amino-1,3-benzoxazol-2-yl)phenol.
Chemical Property Profile of 4-(5-Amino-benzooxazol-2-YL)-phenol
Property Insights of 4-(5-Amino-benzooxazol-2-YL)-phenol
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(5-Amino-benzooxazol-2-YL)-phenol. The TPSA of 72.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(5-Amino-benzooxazol-2-YL)-phenol. Following Lipinski's Rule of Five, 4-(5-Amino-benzooxazol-2-YL)-phenol 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 4-(5-Amino-benzooxazol-2-YL)-phenol?
The CAS number of 4-(5-Amino-benzooxazol-2-YL)-phenol is 54995-54-9.
What is the molecular formula of 4-(5-Amino-benzooxazol-2-YL)-phenol?
The molecular formula of 4-(5-Amino-benzooxazol-2-YL)-phenol is C13H10N2O2.
What is the molecular weight of 4-(5-Amino-benzooxazol-2-YL)-phenol?
The molecular weight of 4-(5-Amino-benzooxazol-2-YL)-phenol is 226.07 g/mol.
Where can I buy 4-(5-Amino-benzooxazol-2-YL)-phenol?
You can request a quote for 4-(5-Amino-benzooxazol-2-YL)-phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(5-Amino-benzooxazol-2-YL)-phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-(5-Amino-benzooxazol-2-YL)-phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.