5-Methyl-2-phenyl-3,1-benzoxazepine
TL;DR: 5-Methyl-2-phenyl-3,1-benzoxazepine (CAS 14300-23-3) is a chemical compound with molecular formula C16H13NO and molecular weight 235.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-2-phenyl-3,1-benzoxazepine
Also Known As: 5-Methyl-2-phenyl-3,1-benzoxazepine, 3,1-Benzoxazepine, 5-methyl-2-phenyl-, 5-Methyl-2-phenyl-3,1-benzoxazepine #, 5-methyl-2-phenylbenzo[d][1,3]oxazepine
| Molecular Formula | C16H13NO |
|---|---|
| Molecular Weight | 235.10 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 21.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 235.09972 |
| Heavy Atoms | 18 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 14300-23-3 |
|---|---|
| SMILES | CC1=COC(=NC2=CC=CC=C12)C3=CC=CC=C3 |
| InChIKey | YJCYZCNDXCMQPG-UHFFFAOYSA-N |
Product Overview
5-Methyl-2-phenyl-3,1-benzoxazepine (CAS 14300-23-3), with molecular formula C16H13NO and molecular weight 235.10 g/mol. IUPAC: 5-methyl-2-phenyl-3,1-benzoxazepine.
Chemical Property Profile of 5-Methyl-2-phenyl-3,1-benzoxazepine
Property Insights of 5-Methyl-2-phenyl-3,1-benzoxazepine
The XLogP value of 3.5 indicates that 5-Methyl-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, 5-Methyl-2-phenyl-3,1-benzoxazepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-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
Frequently Asked Questions
What is the CAS number of 5-Methyl-2-phenyl-3,1-benzoxazepine?
The CAS number of 5-Methyl-2-phenyl-3,1-benzoxazepine is 14300-23-3.
What is the molecular formula of 5-Methyl-2-phenyl-3,1-benzoxazepine?
The molecular formula of 5-Methyl-2-phenyl-3,1-benzoxazepine is C16H13NO.
What is the molecular weight of 5-Methyl-2-phenyl-3,1-benzoxazepine?
The molecular weight of 5-Methyl-2-phenyl-3,1-benzoxazepine is 235.10 g/mol.
Where can I buy 5-Methyl-2-phenyl-3,1-benzoxazepine?
You can request a quote for 5-Methyl-2-phenyl-3,1-benzoxazepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-2-phenyl-3,1-benzoxazepine?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-2-phenyl-3,1-benzoxazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.