2-Phenyl-3,1-benzoxazepine
TL;DR: 2-Phenyl-3,1-benzoxazepine (CAS 14300-21-1) is a chemical compound with molecular formula C15H11NO and molecular weight 221.08406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-phenyl-3,1-benzoxazepine
Also Known As: 2-PHENYL-3,1-BENZOXAZEPINE, 3,1-Benzoxazepine, 2-phenyl-, 2-Phenyl-3,1-benzoxazepine #
Technical Specifications
| Molecular Formula | C15H11NO |
| Molecular Weight | 221.08406 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 21.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.08406 Da |
| Heavy Atoms | 17 |
| Complexity | 315.0 |
| SMILES | C1=CC=C(C=C1)C2=NC3=CC=CC=C3C=CO2 |
| InChIKey | QUXWLCQSCONIQP-UHFFFAOYSA-N |
Chemical Property Profile of 2-Phenyl-3,1-benzoxazepine
Property Insights of 2-Phenyl-3,1-benzoxazepine
The XLogP value of 3.5 indicates that 2-Phenyl-3,1-benzoxazepine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.6 Ų, 2-Phenyl-3,1-benzoxazepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Phenyl-3,1-benzoxazepine 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 2-Phenyl-3,1-benzoxazepine?
The CAS number of 2-Phenyl-3,1-benzoxazepine is 14300-21-1.
What is the molecular formula of 2-Phenyl-3,1-benzoxazepine?
The molecular formula of 2-Phenyl-3,1-benzoxazepine is C15H11NO.
What is the molecular weight of 2-Phenyl-3,1-benzoxazepine?
The molecular weight of 2-Phenyl-3,1-benzoxazepine is 221.08406 g/mol.
Where can I buy 2-Phenyl-3,1-benzoxazepine?
You can request a quote for 2-Phenyl-3,1-benzoxazepine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Phenyl-3,1-benzoxazepine?
Yes, CoreyChem provides custom synthesis services for 2-Phenyl-3,1-benzoxazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.