4,6-Dibromo-2-(3-methylphenyl)-1,3-benzoxazol-5-amine
TL;DR: 4,6-Dibromo-2-(3-methylphenyl)-1,3-benzoxazol-5-amine (CAS 577983-57-4) is a chemical compound with molecular formula C14H10Br2N2O and molecular weight 379.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dibromo-2-(3-methylphenyl)-1,3-benzoxazol-5-amine
Also Known As: 4,6-dibromo-2-(3-methylphenyl)-1,3-benzoxazol-5-amine, 4,6-Dibromo-2-(m-tolyl)benzo[d]oxazol-5-amine, BB 0245239, 4,6-Dibromo-2-m-tolyl-benzooxazol-5-ylamin e, AB01293948-01
| Molecular Formula | C14H10Br2N2O |
|---|---|
| Molecular Weight | 379.92 g/mol |
| LogP | 4.91042 |
| Topological Polar Surface Area | 52.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 379.916 |
| Heavy Atoms | 19 |
| Complexity | 780.45715 |
Chemical Identifiers
| CAS Number | 577983-57-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2=NC3=C(C(=C(C=C3O2)Br)N)Br |
Product Overview
4,6-Dibromo-2-(3-methylphenyl)-1,3-benzoxazol-5-amine (CAS 577983-57-4), with molecular formula C14H10Br2N2O and molecular weight 379.92 g/mol. IUPAC: 4,6-dibromo-2-(3-methylphenyl)-1,3-benzoxazol-5-amine.
Chemical Property Profile of 4,6-Dibromo-2-(3-methylphenyl)-1,3-benzoxazol-5-amine
Property Insights of 4,6-Dibromo-2-(3-methylphenyl)-1,3-benzoxazol-5-amine
The XLogP value of 4.91042 indicates that 4,6-Dibromo-2-(3-methylphenyl)-1,3-benzoxazol-5-amine 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-2-(3-methylphenyl)-1,3-benzoxazol-5-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-Dibromo-2-(3-methylphenyl)-1,3-benzoxazol-5-amine 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 4,6-Dibromo-2-(3-methylphenyl)-1,3-benzoxazol-5-amine?
The CAS number of 4,6-Dibromo-2-(3-methylphenyl)-1,3-benzoxazol-5-amine is 577983-57-4.
What is the molecular formula of 4,6-Dibromo-2-(3-methylphenyl)-1,3-benzoxazol-5-amine?
The molecular formula of 4,6-Dibromo-2-(3-methylphenyl)-1,3-benzoxazol-5-amine is C14H10Br2N2O.
What is the molecular weight of 4,6-Dibromo-2-(3-methylphenyl)-1,3-benzoxazol-5-amine?
The molecular weight of 4,6-Dibromo-2-(3-methylphenyl)-1,3-benzoxazol-5-amine is 379.92 g/mol.
Where can I buy 4,6-Dibromo-2-(3-methylphenyl)-1,3-benzoxazol-5-amine?
You can request a quote for 4,6-Dibromo-2-(3-methylphenyl)-1,3-benzoxazol-5-amine 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-2-(3-methylphenyl)-1,3-benzoxazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Dibromo-2-(3-methylphenyl)-1,3-benzoxazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.