4-(2-苯并噁唑基)苯胺
TL;DR: 4-(2-苯并噁唑基)苯胺 (CAS 20934-81-0) is a chemical compound with molecular formula C13H10N2O and molecular weight 210.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-苯并噁唑基)苯胺
4-(1,3-benzoxazol-2-yl)aniline
Also Known As: 4-(1,3-benzoxazol-2-yl)aniline, 4-(Benzo[d]oxazol-2-yl)aniline, 4-Benzooxazol-2-yl-phenylamine, null, Benzenamine, 4-(2-benzoxazolyl)-
| Molecular Formula | C13H10N2O |
|---|---|
| Molecular Weight | 210.08 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 52.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.07932 |
| Heavy Atoms | 16 |
| Complexity | 238.0 |
| Solubility | 20.8 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 20934-81-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)N |
| InChIKey | XZYQBYQGHHGXBC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(2-苯并噁唑基)苯胺 (CAS 20934-81-0), with molecular formula C13H10N2O and molecular weight 210.08 g/mol. IUPAC: 4-(1,3-benzoxazol-2-yl)aniline.
Chemical Property Profile of 4-(2-苯并噁唑基)苯胺
Property Insights of 4-(2-苯并噁唑基)苯胺
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-苯并噁唑基)苯胺. With a topological polar surface area (TPSA) of 52.1 Ų, 4-(2-苯并噁唑基)苯胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-苯并噁唑基)苯胺 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-(2-苯并噁唑基)苯胺?
The CAS number of 4-(2-苯并噁唑基)苯胺 is 20934-81-0.
What is the molecular formula of 4-(2-苯并噁唑基)苯胺?
The molecular formula of 4-(2-苯并噁唑基)苯胺 is C13H10N2O.
What is the molecular weight of 4-(2-苯并噁唑基)苯胺?
The molecular weight of 4-(2-苯并噁唑基)苯胺 is 210.08 g/mol.
Where can I buy 4-(2-苯并噁唑基)苯胺?
You can request a quote for 4-(2-苯并噁唑基)苯胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-苯并噁唑基)苯胺?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-苯并噁唑基)苯胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.