4-(1,3-Benzoxazol-2-yl)-2-methylaniline
TL;DR: 4-(1,3-Benzoxazol-2-yl)-2-methylaniline (CAS 792946-65-7) 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)-2-methylaniline
Also Known As: 4-(1,3-benzoxazol-2-yl)-2-methylaniline, 4-(Benzo[d]oxazol-2-yl)-2-methylaniline, Benzenamine,4-(2-benzoxazolyl)-2-methyl-, BAS 12517840, 4-Benzooxazol-2-yl-2-methyl-phenylamine
| Molecular Formula | C14H12N2O |
|---|---|
| Molecular Weight | 224.09 g/mol |
| LogP | 3.38542 |
| Topological Polar Surface Area | 52.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 224.09496 |
| Heavy Atoms | 17 |
| Complexity | 652.505 |
Chemical Identifiers
| CAS Number | 792946-65-7 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3O2)N |
Product Overview
4-(1,3-Benzoxazol-2-yl)-2-methylaniline (CAS 792946-65-7), with molecular formula C14H12N2O and molecular weight 224.09 g/mol. IUPAC: 4-(1,3-benzoxazol-2-yl)-2-methylaniline.
Chemical Property Profile of 4-(1,3-Benzoxazol-2-yl)-2-methylaniline
Property Insights of 4-(1,3-Benzoxazol-2-yl)-2-methylaniline
The XLogP value of 3.38542 indicates that 4-(1,3-Benzoxazol-2-yl)-2-methylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.05 Ų, 4-(1,3-Benzoxazol-2-yl)-2-methylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1,3-Benzoxazol-2-yl)-2-methylaniline 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-(1,3-Benzoxazol-2-yl)-2-methylaniline?
The CAS number of 4-(1,3-Benzoxazol-2-yl)-2-methylaniline is 792946-65-7.
What is the molecular formula of 4-(1,3-Benzoxazol-2-yl)-2-methylaniline?
The molecular formula of 4-(1,3-Benzoxazol-2-yl)-2-methylaniline is C14H12N2O.
What is the molecular weight of 4-(1,3-Benzoxazol-2-yl)-2-methylaniline?
The molecular weight of 4-(1,3-Benzoxazol-2-yl)-2-methylaniline is 224.09 g/mol.
Where can I buy 4-(1,3-Benzoxazol-2-yl)-2-methylaniline?
You can request a quote for 4-(1,3-Benzoxazol-2-yl)-2-methylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1,3-Benzoxazol-2-yl)-2-methylaniline?
Yes, KEHONG BIO provides custom synthesis services for 4-(1,3-Benzoxazol-2-yl)-2-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.