2H-Pyridazino(3,4-b)(1,4)benzoxazin-3(5H)-one, 4-chloro-2-methyl-
TL;DR: 2H-Pyridazino(3,4-b)(1,4)benzoxazin-3(5H)-one, 4-chloro-2-methyl- (CAS 66613-93-2) is a chemical compound with molecular formula C11H8ClN3O2 and molecular weight 249.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-methyl-5H-pyridazino[3,4-b][1,4]benzoxazin-3-one
Also Known As: 2H-Pyridazino(3,4-b)(1,4)benzoxazin-3(5H)-one, 4-chloro-2-methyl-, 4-chloro-2-methyl-5H-pyridazino[3,4-b][1,4]benzoxazin-3-one, 4-Chloro-2-methyl-2H-pyridazino[3,4-b][1,4]benzoxazin-3(5H)-one, 4-Chloro-2-methyl-2H-benzo[b]pyridazino[4,3-e][1,4]oxazin-3(5H)-one, 2H-Pyridazino[3,4-b][1,4]benzoxazin-3(5H)-one,4-chloro-2-methyl
| Molecular Formula | C11H8ClN3O2 |
|---|---|
| Molecular Weight | 249.03 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 53.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 249.0305 |
| Heavy Atoms | 17 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 66613-93-2 |
|---|---|
| SMILES | CN1C(=O)C(=C2C(=N1)OC3=CC=CC=C3N2)Cl |
| InChIKey | GATOMHWOUYJEMA-UHFFFAOYSA-N |
Product Overview
2H-Pyridazino(3,4-b)(1,4)benzoxazin-3(5H)-one, 4-chloro-2-methyl- (CAS 66613-93-2), with molecular formula C11H8ClN3O2 and molecular weight 249.03 g/mol. IUPAC: 4-chloro-2-methyl-5H-pyridazino[3,4-b][1,4]benzoxazin-3-one.
Chemical Property Profile of 2H-Pyridazino(3,4-b)(1,4)benzoxazin-3(5H)-one, 4-chloro-2-methyl-
Property Insights of 2H-Pyridazino(3,4-b)(1,4)benzoxazin-3(5H)-one, 4-chloro-2-methyl-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-Pyridazino(3,4-b)(1,4)benzoxazin-3(5H)-one, 4-chloro-2-methyl-. With a topological polar surface area (TPSA) of 53.9 Ų, 2H-Pyridazino(3,4-b)(1,4)benzoxazin-3(5H)-one, 4-chloro-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-Pyridazino(3,4-b)(1,4)benzoxazin-3(5H)-one, 4-chloro-2-methyl- has 1 hydrogen bond donor(s) and 4 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 2H-Pyridazino(3,4-b)(1,4)benzoxazin-3(5H)-one, 4-chloro-2-methyl-?
The CAS number of 2H-Pyridazino(3,4-b)(1,4)benzoxazin-3(5H)-one, 4-chloro-2-methyl- is 66613-93-2.
What is the molecular formula of 2H-Pyridazino(3,4-b)(1,4)benzoxazin-3(5H)-one, 4-chloro-2-methyl-?
The molecular formula of 2H-Pyridazino(3,4-b)(1,4)benzoxazin-3(5H)-one, 4-chloro-2-methyl- is C11H8ClN3O2.
What is the molecular weight of 2H-Pyridazino(3,4-b)(1,4)benzoxazin-3(5H)-one, 4-chloro-2-methyl-?
The molecular weight of 2H-Pyridazino(3,4-b)(1,4)benzoxazin-3(5H)-one, 4-chloro-2-methyl- is 249.03 g/mol.
Where can I buy 2H-Pyridazino(3,4-b)(1,4)benzoxazin-3(5H)-one, 4-chloro-2-methyl-?
You can request a quote for 2H-Pyridazino(3,4-b)(1,4)benzoxazin-3(5H)-one, 4-chloro-2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Pyridazino(3,4-b)(1,4)benzoxazin-3(5H)-one, 4-chloro-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 2H-Pyridazino(3,4-b)(1,4)benzoxazin-3(5H)-one, 4-chloro-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.