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3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine
TL;DR: 3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine (CAS 1016-95-1) is a chemical compound with molecular formula C10H6ClN3O and molecular weight 219.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine
Also Known As: 2-chloro-3,4-diazaphenoxazine, 3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine, 3-Chloro-5H-benzo[b]pyridazino[4,3-e][1,4]oxazine, AH-262/33341039
| Molecular Formula | C10H6ClN3O |
|---|---|
| Molecular Weight | 219.02 g/mol |
| LogP | 2.9793 |
| Topological Polar Surface Area | 47.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 219.01994 |
| Heavy Atoms | 15 |
| Complexity | 529.826 |
Chemical Identifiers
| CAS Number | 1016-95-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC3=CC(=NN=C3O2)Cl |
Product Overview
3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine (CAS 1016-95-1), with molecular formula C10H6ClN3O and molecular weight 219.02 g/mol. IUPAC: 3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine.
Chemical Property Profile of 3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine
Property Insights of 3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine
The XLogP value of 2.9793 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine. With a topological polar surface area (TPSA) of 47.04 Ų, 3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine 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 3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine?
The CAS number of 3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine is 1016-95-1.
What is the molecular formula of 3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine?
The molecular formula of 3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine is C10H6ClN3O.
What is the molecular weight of 3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine?
The molecular weight of 3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine is 219.02 g/mol.
Where can I buy 3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine?
You can request a quote for 3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-5H-pyridazino[3,4-b][1,4]benzoxazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.