4,6-Dibromo-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylaniline
TL;DR: 4,6-Dibromo-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylaniline (CAS 638159-13-4) is a chemical compound with molecular formula C16H14Br2N2O and molecular weight 407.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dibromo-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylaniline
Also Known As: 4,6-DIBROMO-3- -2-METHYLANILINE, BB 0245643, 4,6-dibromo-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylaniline, 4,6-dibromo-3-(5,7-dimethylbenzooxazol-2-yl)-2-methyl-aniline, 4,6-Dibromo-3-(5,7-dimethyl-benzooxazol-2- yl)-2-methyl-phenylamine
| Molecular Formula | C16H14Br2N2O |
|---|---|
| Molecular Weight | 407.95 g/mol |
| LogP | 5.52726 |
| Topological Polar Surface Area | 52.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 407.9473 |
| Heavy Atoms | 21 |
| Complexity | 868.5748 |
Chemical Identifiers
| CAS Number | 638159-13-4 |
|---|---|
| SMILES | CC1=CC(=C2C(=C1)N=C(O2)C3=C(C(=C(C=C3Br)Br)N)C)C |
Product Overview
4,6-Dibromo-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylaniline (CAS 638159-13-4), with molecular formula C16H14Br2N2O and molecular weight 407.95 g/mol. IUPAC: 4,6-dibromo-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylaniline.
Chemical Property Profile of 4,6-Dibromo-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylaniline
Property Insights of 4,6-Dibromo-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylaniline
The XLogP value of 5.52726 indicates that 4,6-Dibromo-3-(5,7-dimethyl-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, 4,6-Dibromo-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-Dibromo-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-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 4,6-Dibromo-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylaniline?
The CAS number of 4,6-Dibromo-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylaniline is 638159-13-4.
What is the molecular formula of 4,6-Dibromo-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylaniline?
The molecular formula of 4,6-Dibromo-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylaniline is C16H14Br2N2O.
What is the molecular weight of 4,6-Dibromo-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylaniline?
The molecular weight of 4,6-Dibromo-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylaniline is 407.95 g/mol.
Where can I buy 4,6-Dibromo-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylaniline?
You can request a quote for 4,6-Dibromo-3-(5,7-dimethyl-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 4,6-Dibromo-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylaniline?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Dibromo-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.