2-Chloro-5-ethyl-pyrido(2,3-b)(1,4)benzoxazepin-6(5H)-one
TL;DR: 2-Chloro-5-ethyl-pyrido(2,3-b)(1,4)benzoxazepin-6(5H)-one (CAS 140413-08-7) is a chemical compound with molecular formula C14H11ClN2O2 and molecular weight 274.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-5-ethylpyrido[2,3-b][1,4]benzoxazepin-6-one
Also Known As: 2Cl-5Et-PBOA-6one, 2-Chloro-5-ethyl-pyrido(2,3-b)(1,4)benzoxazepin-6(5H)-one, 2-chloro-5-ethylpyrido[2,3-b][1,4]benzoxazepin-6-one, Pyrido[2,3-b][1,4]benzoxazepin-6(5H)-one,2-chloro-5-ethyl-, 2-chloro-5-ethyl-pyrido[2,3-b][1,4]benzoxazepin-6-one
| Molecular Formula | C14H11ClN2O2 |
|---|---|
| Molecular Weight | 274.05 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 274.0509 |
| Heavy Atoms | 19 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 140413-08-7 |
|---|---|
| SMILES | CCN1C2=C(N=C(C=C2)Cl)OC3=CC=CC=C3C1=O |
| InChIKey | NHZLSVSTKSZEPP-UHFFFAOYSA-N |
Product Overview
2-Chloro-5-ethyl-pyrido(2,3-b)(1,4)benzoxazepin-6(5H)-one (CAS 140413-08-7), with molecular formula C14H11ClN2O2 and molecular weight 274.05 g/mol. IUPAC: 2-chloro-5-ethylpyrido[2,3-b][1,4]benzoxazepin-6-one.
Chemical Property Profile of 2-Chloro-5-ethyl-pyrido(2,3-b)(1,4)benzoxazepin-6(5H)-one
Property Insights of 2-Chloro-5-ethyl-pyrido(2,3-b)(1,4)benzoxazepin-6(5H)-one
The XLogP value of 3.1 indicates that 2-Chloro-5-ethyl-pyrido(2,3-b)(1,4)benzoxazepin-6(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.4 Ų, 2-Chloro-5-ethyl-pyrido(2,3-b)(1,4)benzoxazepin-6(5H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-5-ethyl-pyrido(2,3-b)(1,4)benzoxazepin-6(5H)-one has 0 hydrogen bond donor(s) and 3 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 2-Chloro-5-ethyl-pyrido(2,3-b)(1,4)benzoxazepin-6(5H)-one?
The CAS number of 2-Chloro-5-ethyl-pyrido(2,3-b)(1,4)benzoxazepin-6(5H)-one is 140413-08-7.
What is the molecular formula of 2-Chloro-5-ethyl-pyrido(2,3-b)(1,4)benzoxazepin-6(5H)-one?
The molecular formula of 2-Chloro-5-ethyl-pyrido(2,3-b)(1,4)benzoxazepin-6(5H)-one is C14H11ClN2O2.
What is the molecular weight of 2-Chloro-5-ethyl-pyrido(2,3-b)(1,4)benzoxazepin-6(5H)-one?
The molecular weight of 2-Chloro-5-ethyl-pyrido(2,3-b)(1,4)benzoxazepin-6(5H)-one is 274.05 g/mol.
Where can I buy 2-Chloro-5-ethyl-pyrido(2,3-b)(1,4)benzoxazepin-6(5H)-one?
You can request a quote for 2-Chloro-5-ethyl-pyrido(2,3-b)(1,4)benzoxazepin-6(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-5-ethyl-pyrido(2,3-b)(1,4)benzoxazepin-6(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-5-ethyl-pyrido(2,3-b)(1,4)benzoxazepin-6(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.