![6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one structure](/static/products/304/304854-45-3.png)
6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one
TL;DR: 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one (CAS 304854-45-3) is a chemical compound with molecular formula C16H13ClFNO2 and molecular weight 305.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one
Also Known As: 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one, 6-(3-Chloro-4-fluoro-phenyl)-4,4-dimethyl-1,4-dihydro-benzo[d][1,3]oxazin-2-one, 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1,4-dihydro-2h-3,1-benzoxazin-2-one, 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-3,1-benzoxazin-2, 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one
| Molecular Formula | C16H13ClFNO2 |
|---|---|
| Molecular Weight | 305.06 g/mol |
| LogP | 4.9433 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 305.0619 |
| Heavy Atoms | 21 |
| Complexity | 743.052 |
Chemical Identifiers
| CAS Number | 304854-45-3 |
|---|---|
| SMILES | CC1(C2=C(C=CC(=C2)C3=CC(=C(C=C3)F)Cl)NC(=O)O1)C |
Product Overview
6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one (CAS 304854-45-3), with molecular formula C16H13ClFNO2 and molecular weight 305.06 g/mol. IUPAC: 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one.
Chemical Property Profile of 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one
Property Insights of 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one
The XLogP value of 4.9433 indicates that 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one has 1 hydrogen bond donor(s) and 2 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 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one?
The CAS number of 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one is 304854-45-3.
What is the molecular formula of 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one?
The molecular formula of 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one is C16H13ClFNO2.
What is the molecular weight of 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one?
The molecular weight of 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one is 305.06 g/mol.
Where can I buy 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one?
You can request a quote for 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for 6-(3-chloro-4-fluorophenyl)-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.