![5-(5-Isopropylbenzo[d]oxazol-2-yl)-2-methylaniline structure](/static/products/4296/429653-20-3.webp)
5-(5-Isopropylbenzo[d]oxazol-2-yl)-2-methylaniline
TL;DR: 5-(5-Isopropylbenzo[d]oxazol-2-yl)-2-methylaniline (CAS 429653-20-3) is a chemical compound with molecular formula C17H18N2O and molecular weight 266.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-(5-propan-2-yl-1,3-benzoxazol-2-yl)aniline
Also Known As: 5-(5-Isopropylbenzo[d]oxazol-2-yl)-2-methylaniline, 5-(5-Isopropyl-benzooxazol-2-yl)-2-methyl-phenylamine, BAS 03847197, 2-methyl-5-(5-propan-2-yl-1,3-benzoxazol-2-yl)aniline, BB 0245631
| Molecular Formula | C17H18N2O |
|---|---|
| Molecular Weight | 266.14 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 52.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.1419 |
| Heavy Atoms | 20 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 429653-20-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C(C)C)N |
| InChIKey | PPHPCJULUZQELN-UHFFFAOYSA-N |
Product Overview
5-(5-Isopropylbenzo[d]oxazol-2-yl)-2-methylaniline (CAS 429653-20-3), with molecular formula C17H18N2O and molecular weight 266.14 g/mol. IUPAC: 2-methyl-5-(5-propan-2-yl-1,3-benzoxazol-2-yl)aniline.
Chemical Property Profile of 5-(5-Isopropylbenzo[d]oxazol-2-yl)-2-methylaniline
Property Insights of 5-(5-Isopropylbenzo[d]oxazol-2-yl)-2-methylaniline
The XLogP value of 4.2 indicates that 5-(5-Isopropylbenzo[d]oxazol-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 52.1 Ų, 5-(5-Isopropylbenzo[d]oxazol-2-yl)-2-methylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(5-Isopropylbenzo[d]oxazol-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 5-(5-Isopropylbenzo[d]oxazol-2-yl)-2-methylaniline?
The CAS number of 5-(5-Isopropylbenzo[d]oxazol-2-yl)-2-methylaniline is 429653-20-3.
What is the molecular formula of 5-(5-Isopropylbenzo[d]oxazol-2-yl)-2-methylaniline?
The molecular formula of 5-(5-Isopropylbenzo[d]oxazol-2-yl)-2-methylaniline is C17H18N2O.
What is the molecular weight of 5-(5-Isopropylbenzo[d]oxazol-2-yl)-2-methylaniline?
The molecular weight of 5-(5-Isopropylbenzo[d]oxazol-2-yl)-2-methylaniline is 266.14 g/mol.
Where can I buy 5-(5-Isopropylbenzo[d]oxazol-2-yl)-2-methylaniline?
You can request a quote for 5-(5-Isopropylbenzo[d]oxazol-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 5-(5-Isopropylbenzo[d]oxazol-2-yl)-2-methylaniline?
Yes, KEHONG BIO provides custom synthesis services for 5-(5-Isopropylbenzo[d]oxazol-2-yl)-2-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.