7-chloro-4H-pyrimido(1,2-b)pyridazin-4-one
TL;DR: 7-chloro-4H-pyrimido(1,2-b)pyridazin-4-one (CAS 88820-50-2) is a chemical compound with molecular formula C7H4ClN3O and molecular weight 181.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloropyrimido[1,2-b]pyridazin-4-one
Also Known As: 7-chloro-4H-pyrimido[1,2-b]pyridazin-4-one, 4H-pyrimido[1,2-b]pyridazin-4-one, 7-chloro-, 7-chloropyrimido[1,2-b]pyridazin-4-one, 7-chloro-4H-pyrimido(1,2-b)pyridazin-4-one, 4H-pyrimido[1,2-b]pyridazin-4-one,7-chloro-
| Molecular Formula | C7H4ClN3O |
|---|---|
| Molecular Weight | 181.00 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 45.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 181.00429 |
| Heavy Atoms | 12 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 88820-50-2 |
|---|---|
| SMILES | C1=CC(=NN2C1=NC=CC2=O)Cl |
| InChIKey | MPKXVJMKKYHTIP-UHFFFAOYSA-N |
Product Overview
7-chloro-4H-pyrimido(1,2-b)pyridazin-4-one (CAS 88820-50-2), with molecular formula C7H4ClN3O and molecular weight 181.00 g/mol. IUPAC: 7-chloropyrimido[1,2-b]pyridazin-4-one.
Chemical Property Profile of 7-chloro-4H-pyrimido(1,2-b)pyridazin-4-one
Property Insights of 7-chloro-4H-pyrimido(1,2-b)pyridazin-4-one
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-chloro-4H-pyrimido(1,2-b)pyridazin-4-one. With a topological polar surface area (TPSA) of 45.0 Ų, 7-chloro-4H-pyrimido(1,2-b)pyridazin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-chloro-4H-pyrimido(1,2-b)pyridazin-4-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 7-chloro-4H-pyrimido(1,2-b)pyridazin-4-one?
The CAS number of 7-chloro-4H-pyrimido(1,2-b)pyridazin-4-one is 88820-50-2.
What is the molecular formula of 7-chloro-4H-pyrimido(1,2-b)pyridazin-4-one?
The molecular formula of 7-chloro-4H-pyrimido(1,2-b)pyridazin-4-one is C7H4ClN3O.
What is the molecular weight of 7-chloro-4H-pyrimido(1,2-b)pyridazin-4-one?
The molecular weight of 7-chloro-4H-pyrimido(1,2-b)pyridazin-4-one is 181.00 g/mol.
Where can I buy 7-chloro-4H-pyrimido(1,2-b)pyridazin-4-one?
You can request a quote for 7-chloro-4H-pyrimido(1,2-b)pyridazin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-chloro-4H-pyrimido(1,2-b)pyridazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 7-chloro-4H-pyrimido(1,2-b)pyridazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.