2-amino-4-methylphthalazin-1(2H)-one
TL;DR: 2-amino-4-methylphthalazin-1(2H)-one (CAS 887579-31-9) is a chemical compound with molecular formula C9H9N3O and molecular weight 175.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-methylphthalazin-1-one
Also Known As: 2-amino-4-methylphthalazin-1(2H)-one, 2-amino-4-methylphthalazin-1-one, 2-Amino-4-methyl-1(2H)-phthalazinone, 2-amino-4-methyl-2-hydrophthalazin-1-one, 2-amino-4-methyl-1,2-dihydrophthalazin-1-one
| Molecular Formula | C9H9N3O |
|---|---|
| Molecular Weight | 175.07 g/mol |
| LogP | 0.41872 |
| Topological Polar Surface Area | 60.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 175.07455 |
| Heavy Atoms | 13 |
| Complexity | 515.739 |
Chemical Identifiers
| CAS Number | 887579-31-9 |
|---|---|
| SMILES | CC1=NN(C(=O)C2=CC=CC=C12)N |
Product Overview
2-amino-4-methylphthalazin-1(2H)-one (CAS 887579-31-9), with molecular formula C9H9N3O and molecular weight 175.07 g/mol. IUPAC: 2-amino-4-methylphthalazin-1-one.
Chemical Property Profile of 2-amino-4-methylphthalazin-1(2H)-one
Property Insights of 2-amino-4-methylphthalazin-1(2H)-one
The XLogP value of 0.41872 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-amino-4-methylphthalazin-1(2H)-one. The TPSA of 60.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-4-methylphthalazin-1(2H)-one. Following Lipinski's Rule of Five, 2-amino-4-methylphthalazin-1(2H)-one has 1 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-amino-4-methylphthalazin-1(2H)-one?
The CAS number of 2-amino-4-methylphthalazin-1(2H)-one is 887579-31-9.
What is the molecular formula of 2-amino-4-methylphthalazin-1(2H)-one?
The molecular formula of 2-amino-4-methylphthalazin-1(2H)-one is C9H9N3O.
What is the molecular weight of 2-amino-4-methylphthalazin-1(2H)-one?
The molecular weight of 2-amino-4-methylphthalazin-1(2H)-one is 175.07 g/mol.
Where can I buy 2-amino-4-methylphthalazin-1(2H)-one?
You can request a quote for 2-amino-4-methylphthalazin-1(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amino-4-methylphthalazin-1(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-4-methylphthalazin-1(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.