(4-Chlorophenyl)(3-hydroxy-2-methyl-2H-1,4-benzoxazin-7-yl)methanone
TL;DR: (4-Chlorophenyl)(3-hydroxy-2-methyl-2H-1,4-benzoxazin-7-yl)methanone (CAS 123172-51-0) is a chemical compound with molecular formula C16H12ClNO3 and molecular weight 301.05057 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-(4-chlorobenzoyl)-2-methyl-4H-1,4-benzoxazin-3-one
Also Known As: (+-)-7-(4-Chlorobenzoyl)-2-methyl-2H-1,4-benzoxazin-3(4H)-one, 2H-1,4-Benzoxazin-3(4H)-one, 7-(4-chlorobenzoyl)-2-methyl-, (+-)-, 7-(4-chlorobenzoyl)-2-methyl-4H-1,4-benzoxazin-3-one, (4-Chlorophenyl)(3-hydroxy-2-methyl-2H-1,4-benzoxazin-7-yl)methanone, BRN 5973318
Technical Specifications
| Molecular Formula | C16H12ClNO3 |
| Molecular Weight | 301.05057 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 301.05057 Da |
| Heavy Atoms | 21 |
| Complexity | 420.0 |
| SMILES | CC1C(=O)NC2=C(O1)C=C(C=C2)C(=O)C3=CC=C(C=C3)Cl |
| InChIKey | MAQISQMPSBDBBP-UHFFFAOYSA-N |
Chemical Property Profile of (4-Chlorophenyl)(3-hydroxy-2-methyl-2H-1,4-benzoxazin-7-yl)methanone
Property Insights of (4-Chlorophenyl)(3-hydroxy-2-methyl-2H-1,4-benzoxazin-7-yl)methanone
The XLogP value of 3.2 indicates that (4-Chlorophenyl)(3-hydroxy-2-methyl-2H-1,4-benzoxazin-7-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, (4-Chlorophenyl)(3-hydroxy-2-methyl-2H-1,4-benzoxazin-7-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Chlorophenyl)(3-hydroxy-2-methyl-2H-1,4-benzoxazin-7-yl)methanone 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
What is the CAS number of (4-Chlorophenyl)(3-hydroxy-2-methyl-2H-1,4-benzoxazin-7-yl)methanone?
The CAS number of (4-Chlorophenyl)(3-hydroxy-2-methyl-2H-1,4-benzoxazin-7-yl)methanone is 123172-51-0.
What is the molecular formula of (4-Chlorophenyl)(3-hydroxy-2-methyl-2H-1,4-benzoxazin-7-yl)methanone?
The molecular formula of (4-Chlorophenyl)(3-hydroxy-2-methyl-2H-1,4-benzoxazin-7-yl)methanone is C16H12ClNO3.
What is the molecular weight of (4-Chlorophenyl)(3-hydroxy-2-methyl-2H-1,4-benzoxazin-7-yl)methanone?
The molecular weight of (4-Chlorophenyl)(3-hydroxy-2-methyl-2H-1,4-benzoxazin-7-yl)methanone is 301.05057 g/mol.
Where can I buy (4-Chlorophenyl)(3-hydroxy-2-methyl-2H-1,4-benzoxazin-7-yl)methanone?
You can request a quote for (4-Chlorophenyl)(3-hydroxy-2-methyl-2H-1,4-benzoxazin-7-yl)methanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (4-Chlorophenyl)(3-hydroxy-2-methyl-2H-1,4-benzoxazin-7-yl)methanone?
Yes, CoreyChem provides custom synthesis services for (4-Chlorophenyl)(3-hydroxy-2-methyl-2H-1,4-benzoxazin-7-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.