4-bromo-5-(methylamino)-2-(2-oxopropyl)-3(2H)-pyridazinone
TL;DR: 4-bromo-5-(methylamino)-2-(2-oxopropyl)-3(2H)-pyridazinone (CAS 198023-95-9) is a chemical compound with molecular formula C8H10BrN3O2 and molecular weight 259.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-5-(methylamino)-2-(2-oxopropyl)pyridazin-3-one
Also Known As: 11N-362S, 4-bromo-5-(methylamino)-2-(2-oxopropyl)-3(2H)-pyridazinone, 4-bromo-5-(methylamino)-2-(2-oxopropyl)pyridazin-3-one, 4-bromo-5-(methylamino)-2-(2-oxopropyl)-2,3-dihydropyridazin-3-one, 2-(2-Oxopropyl)-4-bromo-5-(methylamino)pyridazin-3(2H)-one
| Molecular Formula | C8H10BrN3O2 |
|---|---|
| Molecular Weight | 259.00 g/mol |
| LogP | 0.6365 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.99564 |
| Heavy Atoms | 14 |
| Complexity | 413.5377 |
Chemical Identifiers
| CAS Number | 198023-95-9 |
|---|---|
| SMILES | CC(=O)CN1C(=O)C(=C(C=N1)NC)Br |
Product Overview
4-bromo-5-(methylamino)-2-(2-oxopropyl)-3(2H)-pyridazinone (CAS 198023-95-9), with molecular formula C8H10BrN3O2 and molecular weight 259.00 g/mol. IUPAC: 4-bromo-5-(methylamino)-2-(2-oxopropyl)pyridazin-3-one.
Chemical Property Profile of 4-bromo-5-(methylamino)-2-(2-oxopropyl)-3(2H)-pyridazinone
Property Insights of 4-bromo-5-(methylamino)-2-(2-oxopropyl)-3(2H)-pyridazinone
The XLogP value of 0.6365 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-bromo-5-(methylamino)-2-(2-oxopropyl)-3(2H)-pyridazinone. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-bromo-5-(methylamino)-2-(2-oxopropyl)-3(2H)-pyridazinone. Following Lipinski's Rule of Five, 4-bromo-5-(methylamino)-2-(2-oxopropyl)-3(2H)-pyridazinone 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 4-bromo-5-(methylamino)-2-(2-oxopropyl)-3(2H)-pyridazinone?
The CAS number of 4-bromo-5-(methylamino)-2-(2-oxopropyl)-3(2H)-pyridazinone is 198023-95-9.
What is the molecular formula of 4-bromo-5-(methylamino)-2-(2-oxopropyl)-3(2H)-pyridazinone?
The molecular formula of 4-bromo-5-(methylamino)-2-(2-oxopropyl)-3(2H)-pyridazinone is C8H10BrN3O2.
What is the molecular weight of 4-bromo-5-(methylamino)-2-(2-oxopropyl)-3(2H)-pyridazinone?
The molecular weight of 4-bromo-5-(methylamino)-2-(2-oxopropyl)-3(2H)-pyridazinone is 259.00 g/mol.
Where can I buy 4-bromo-5-(methylamino)-2-(2-oxopropyl)-3(2H)-pyridazinone?
You can request a quote for 4-bromo-5-(methylamino)-2-(2-oxopropyl)-3(2H)-pyridazinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-5-(methylamino)-2-(2-oxopropyl)-3(2H)-pyridazinone?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-5-(methylamino)-2-(2-oxopropyl)-3(2H)-pyridazinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.