2,4-Dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline
TL;DR: 2,4-Dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline (CAS 638159-31-6) is a chemical compound with molecular formula C14H9Br2ClN2O and molecular weight 413.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline
Also Known As: ASISCHEM V03763, 2,4-dibromo-3-(5-chlorobenzooxazol-2-yl)-6-methyl-aniline, 2,4-dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline
| Molecular Formula | C14H9Br2ClN2O |
|---|---|
| Molecular Weight | 413.88 g/mol |
| LogP | 5.56382 |
| Topological Polar Surface Area | 52.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 413.877 |
| Heavy Atoms | 20 |
| Complexity | 829.6422 |
Chemical Identifiers
| CAS Number | 638159-31-6 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1N)Br)C2=NC3=C(O2)C=CC(=C3)Cl)Br |
Product Overview
2,4-Dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline (CAS 638159-31-6), with molecular formula C14H9Br2ClN2O and molecular weight 413.88 g/mol. IUPAC: 2,4-dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline.
Chemical Property Profile of 2,4-Dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline
Property Insights of 2,4-Dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline
The XLogP value of 5.56382 indicates that 2,4-Dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-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, 2,4-Dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4-Dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline?
The CAS number of 2,4-Dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline is 638159-31-6.
What is the molecular formula of 2,4-Dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline?
The molecular formula of 2,4-Dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline is C14H9Br2ClN2O.
What is the molecular weight of 2,4-Dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline?
The molecular weight of 2,4-Dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline is 413.88 g/mol.
Where can I buy 2,4-Dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline?
You can request a quote for 2,4-Dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dibromo-3-(5-chloro-1,3-benzoxazol-2-yl)-6-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.