![2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one structure](/static/products/1860/18600-52-7.webp)
2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one
TL;DR: 2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one (CAS 18600-52-7) is a chemical compound with molecular formula C14H8ClNO2 and molecular weight 257.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-3,1-benzoxazin-4-one
Also Known As: 2-(4-chlorophenyl)-4H-3,1-benzoxazin-4-one, 2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one, 2-(4-chlorophenyl)-3,1-benzoxazin-4-one, 2-(p-Chlorophenyl)-4H-3,1-benzoxazin-4-one, BAS 00084955
| Molecular Formula | C14H8ClNO2 |
|---|---|
| Molecular Weight | 257.02 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 257.02435 |
| Heavy Atoms | 18 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 18600-52-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)OC(=N2)C3=CC=C(C=C3)Cl |
| InChIKey | OMXNVOLVJFGYGQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one (CAS 18600-52-7), with molecular formula C14H8ClNO2 and molecular weight 257.02 g/mol. IUPAC: 2-(4-chlorophenyl)-3,1-benzoxazin-4-one.
Chemical Property Profile of 2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one
Property Insights of 2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one
The XLogP value of 3.6 indicates that 2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.7 Ų, 2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one 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 2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one?
The CAS number of 2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one is 18600-52-7.
What is the molecular formula of 2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one?
The molecular formula of 2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one is C14H8ClNO2.
What is the molecular weight of 2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one?
The molecular weight of 2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one is 257.02 g/mol.
Where can I buy 2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one?
You can request a quote for 2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Chlorophenyl)-4H-benzo[d][1,3]oxazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.