4-Chloro-3-(6-methyl-2-benzoxazolyl)benzenamine
TL;DR: 4-Chloro-3-(6-methyl-2-benzoxazolyl)benzenamine (CAS 293737-71-0) is a chemical compound with molecular formula C14H11ClN2O and molecular weight 258.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)aniline
Also Known As: 4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)aniline, 4-Chloro-3-(6-methylbenzo[d]oxazol-2-yl)aniline, BAS 06839653, BIM-0015440.P001, 4-Chloro-3-(6-methyl-2-benzoxazolyl)benzenamine
| Molecular Formula | C14H11ClN2O |
|---|---|
| Molecular Weight | 258.06 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 52.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 258.056 |
| Heavy Atoms | 18 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 293737-71-0 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(O2)C3=C(C=CC(=C3)N)Cl |
| InChIKey | POZZQIAFABBLQO-UHFFFAOYSA-N |
Product Overview
4-Chloro-3-(6-methyl-2-benzoxazolyl)benzenamine (CAS 293737-71-0), with molecular formula C14H11ClN2O and molecular weight 258.06 g/mol. IUPAC: 4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)aniline.
Chemical Property Profile of 4-Chloro-3-(6-methyl-2-benzoxazolyl)benzenamine
Property Insights of 4-Chloro-3-(6-methyl-2-benzoxazolyl)benzenamine
The XLogP value of 3.7 indicates that 4-Chloro-3-(6-methyl-2-benzoxazolyl)benzenamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.1 Ų, 4-Chloro-3-(6-methyl-2-benzoxazolyl)benzenamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-3-(6-methyl-2-benzoxazolyl)benzenamine 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-Chloro-3-(6-methyl-2-benzoxazolyl)benzenamine?
The CAS number of 4-Chloro-3-(6-methyl-2-benzoxazolyl)benzenamine is 293737-71-0.
What is the molecular formula of 4-Chloro-3-(6-methyl-2-benzoxazolyl)benzenamine?
The molecular formula of 4-Chloro-3-(6-methyl-2-benzoxazolyl)benzenamine is C14H11ClN2O.
What is the molecular weight of 4-Chloro-3-(6-methyl-2-benzoxazolyl)benzenamine?
The molecular weight of 4-Chloro-3-(6-methyl-2-benzoxazolyl)benzenamine is 258.06 g/mol.
Where can I buy 4-Chloro-3-(6-methyl-2-benzoxazolyl)benzenamine?
You can request a quote for 4-Chloro-3-(6-methyl-2-benzoxazolyl)benzenamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-3-(6-methyl-2-benzoxazolyl)benzenamine?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-3-(6-methyl-2-benzoxazolyl)benzenamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.