6-Chloro-1-methyl-4-phenyl-1,4-dihydro-2H-3,1-benzoxazin-2-one
TL;DR: 6-Chloro-1-methyl-4-phenyl-1,4-dihydro-2H-3,1-benzoxazin-2-one (CAS 13213-94-0) is a chemical compound with molecular formula C15H12ClNO2 and molecular weight 273.05566 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-chloro-1-methyl-4-phenyl-4H-3,1-benzoxazin-2-one
Also Known As: 1,4-Dihydro-6-chloro-1-methyl-4-phenyl-2H-3,1-benzoxazin-2-one, 6-chloro-1-methyl-4-phenyl-4H-3,1-benzoxazin-2-one, 4-Phenyl-6-chloro-1-methyl-1,4-dihydro-2H-3,1-benzoxazin-2-one, 2H-3,1-Benzoxazin-2-one, 1,4-dihydro-6-chloro-1-methyl-4-phenyl-, 6-chloro-1-methyl-4-phenyl-1,4-dihydro-2H-3,1-benzoxazin-2-one
Technical Specifications
| Molecular Formula | C15H12ClNO2 |
| Molecular Weight | 273.05566 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 273.05566 Da |
| Heavy Atoms | 19 |
| Complexity | 343.0 |
| SMILES | CN1C2=C(C=C(C=C2)Cl)C(OC1=O)C3=CC=CC=C3 |
| InChIKey | MXEYGYIUXHNLIS-UHFFFAOYSA-N |
Chemical Property Profile of 6-Chloro-1-methyl-4-phenyl-1,4-dihydro-2H-3,1-benzoxazin-2-one
Property Insights of 6-Chloro-1-methyl-4-phenyl-1,4-dihydro-2H-3,1-benzoxazin-2-one
The XLogP value of 3.6 indicates that 6-Chloro-1-methyl-4-phenyl-1,4-dihydro-2H-3,1-benzoxazin-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 6-Chloro-1-methyl-4-phenyl-1,4-dihydro-2H-3,1-benzoxazin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-1-methyl-4-phenyl-1,4-dihydro-2H-3,1-benzoxazin-2-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 6-Chloro-1-methyl-4-phenyl-1,4-dihydro-2H-3,1-benzoxazin-2-one?
The CAS number of 6-Chloro-1-methyl-4-phenyl-1,4-dihydro-2H-3,1-benzoxazin-2-one is 13213-94-0.
What is the molecular formula of 6-Chloro-1-methyl-4-phenyl-1,4-dihydro-2H-3,1-benzoxazin-2-one?
The molecular formula of 6-Chloro-1-methyl-4-phenyl-1,4-dihydro-2H-3,1-benzoxazin-2-one is C15H12ClNO2.
What is the molecular weight of 6-Chloro-1-methyl-4-phenyl-1,4-dihydro-2H-3,1-benzoxazin-2-one?
The molecular weight of 6-Chloro-1-methyl-4-phenyl-1,4-dihydro-2H-3,1-benzoxazin-2-one is 273.05566 g/mol.
Where can I buy 6-Chloro-1-methyl-4-phenyl-1,4-dihydro-2H-3,1-benzoxazin-2-one?
You can request a quote for 6-Chloro-1-methyl-4-phenyl-1,4-dihydro-2H-3,1-benzoxazin-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-Chloro-1-methyl-4-phenyl-1,4-dihydro-2H-3,1-benzoxazin-2-one?
Yes, CoreyChem provides custom synthesis services for 6-Chloro-1-methyl-4-phenyl-1,4-dihydro-2H-3,1-benzoxazin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.