10-Ally-dibenz(b,f)(1,4)oxazepin-11-(10H)-one
TL;DR: 10-Ally-dibenz(b,f)(1,4)oxazepin-11-(10H)-one (CAS 135810-46-7) is a chemical compound with molecular formula C16H13NO2 and molecular weight 251.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-prop-2-enylbenzo[b][1,4]benzoxazepin-6-one
Also Known As: 10Allyl-DBOA-11one, Dibenzoxazepinone 11, 10-Ally-dibenz(b,f)(1,4)oxazepin-11-(10H)-one, 5-Prop-2-enylbenzo(b)(1,4)benzoxazepin-6-one, 5-allylbenzo[b][1,4]benzoxazepin-6-one
| Molecular Formula | C16H13NO2 |
|---|---|
| Molecular Weight | 251.09 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.09464 |
| Heavy Atoms | 19 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 135810-46-7 |
|---|---|
| SMILES | C=CCN1C2=CC=CC=C2OC3=CC=CC=C3C1=O |
| InChIKey | QANXXCPLBYYJSG-UHFFFAOYSA-N |
Product Overview
10-Ally-dibenz(b,f)(1,4)oxazepin-11-(10H)-one (CAS 135810-46-7), with molecular formula C16H13NO2 and molecular weight 251.09 g/mol. IUPAC: 5-prop-2-enylbenzo[b][1,4]benzoxazepin-6-one.
Chemical Property Profile of 10-Ally-dibenz(b,f)(1,4)oxazepin-11-(10H)-one
Property Insights of 10-Ally-dibenz(b,f)(1,4)oxazepin-11-(10H)-one
The XLogP value of 3.2 indicates that 10-Ally-dibenz(b,f)(1,4)oxazepin-11-(10H)-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, 10-Ally-dibenz(b,f)(1,4)oxazepin-11-(10H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 10-Ally-dibenz(b,f)(1,4)oxazepin-11-(10H)-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
Frequently Asked Questions
What is the CAS number of 10-Ally-dibenz(b,f)(1,4)oxazepin-11-(10H)-one?
The CAS number of 10-Ally-dibenz(b,f)(1,4)oxazepin-11-(10H)-one is 135810-46-7.
What is the molecular formula of 10-Ally-dibenz(b,f)(1,4)oxazepin-11-(10H)-one?
The molecular formula of 10-Ally-dibenz(b,f)(1,4)oxazepin-11-(10H)-one is C16H13NO2.
What is the molecular weight of 10-Ally-dibenz(b,f)(1,4)oxazepin-11-(10H)-one?
The molecular weight of 10-Ally-dibenz(b,f)(1,4)oxazepin-11-(10H)-one is 251.09 g/mol.
Where can I buy 10-Ally-dibenz(b,f)(1,4)oxazepin-11-(10H)-one?
You can request a quote for 10-Ally-dibenz(b,f)(1,4)oxazepin-11-(10H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10-Ally-dibenz(b,f)(1,4)oxazepin-11-(10H)-one?
Yes, KEHONG BIO provides custom synthesis services for 10-Ally-dibenz(b,f)(1,4)oxazepin-11-(10H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.