4H-3,1-Benzoxazin-4-one, 6-bromo-2-(2-phenylethenyl)-
TL;DR: 4H-3,1-Benzoxazin-4-one, 6-bromo-2-(2-phenylethenyl)- (CAS 71822-63-4) is a chemical compound with molecular formula C16H10BrNO2 and molecular weight 326.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-2-(2-phenylethenyl)-3,1-benzoxazin-4-one
Also Known As: BAS 01170293, 4H-3,1-Benzoxazin-4-one, 6-bromo-2-(2-phenylethenyl)-, 6-bromo-2-(2-phenylethenyl)-3,1-benzoxazin-4-one, 6-Bromo-2-styryl-benzo[d][1,3]oxazin-4-one, 6-Bromo-2-(2-phenylethen-1-yl)-4H-3,1-benzoxazin-4-one
| Molecular Formula | C16H10BrNO2 |
|---|---|
| Molecular Weight | 326.99 g/mol |
| LogP | 4.1209 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 326.9895 |
| Heavy Atoms | 20 |
| Complexity | 837.96985 |
Chemical Identifiers
| CAS Number | 71822-63-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CC2=NC3=C(C=C(C=C3)Br)C(=O)O2 |
Product Overview
4H-3,1-Benzoxazin-4-one, 6-bromo-2-(2-phenylethenyl)- (CAS 71822-63-4), with molecular formula C16H10BrNO2 and molecular weight 326.99 g/mol. IUPAC: 6-bromo-2-(2-phenylethenyl)-3,1-benzoxazin-4-one.
Chemical Property Profile of 4H-3,1-Benzoxazin-4-one, 6-bromo-2-(2-phenylethenyl)-
Property Insights of 4H-3,1-Benzoxazin-4-one, 6-bromo-2-(2-phenylethenyl)-
The XLogP value of 4.1209 indicates that 4H-3,1-Benzoxazin-4-one, 6-bromo-2-(2-phenylethenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.1 Ų, 4H-3,1-Benzoxazin-4-one, 6-bromo-2-(2-phenylethenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-3,1-Benzoxazin-4-one, 6-bromo-2-(2-phenylethenyl)- has 0 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 4H-3,1-Benzoxazin-4-one, 6-bromo-2-(2-phenylethenyl)-?
The CAS number of 4H-3,1-Benzoxazin-4-one, 6-bromo-2-(2-phenylethenyl)- is 71822-63-4.
What is the molecular formula of 4H-3,1-Benzoxazin-4-one, 6-bromo-2-(2-phenylethenyl)-?
The molecular formula of 4H-3,1-Benzoxazin-4-one, 6-bromo-2-(2-phenylethenyl)- is C16H10BrNO2.
What is the molecular weight of 4H-3,1-Benzoxazin-4-one, 6-bromo-2-(2-phenylethenyl)-?
The molecular weight of 4H-3,1-Benzoxazin-4-one, 6-bromo-2-(2-phenylethenyl)- is 326.99 g/mol.
Where can I buy 4H-3,1-Benzoxazin-4-one, 6-bromo-2-(2-phenylethenyl)-?
You can request a quote for 4H-3,1-Benzoxazin-4-one, 6-bromo-2-(2-phenylethenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-3,1-Benzoxazin-4-one, 6-bromo-2-(2-phenylethenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 4H-3,1-Benzoxazin-4-one, 6-bromo-2-(2-phenylethenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.