4-(Aminomethyl)-2-methyl-1,2-dihydrophthalazin-1-one
TL;DR: 4-(Aminomethyl)-2-methyl-1,2-dihydrophthalazin-1-one (CAS 49837-96-9) is a chemical compound with molecular formula C10H11N3O and molecular weight 189.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(aminomethyl)-2-methylphthalazin-1-one
Also Known As: 4-(aminomethyl)-2-methyl-1,2-dihydrophthalazin-1-one, 4-Aminomethyl-2-methyl-2H-phthalazin-1-one, 4-(aminomethyl)-2-methylphthalazin-1-one, 4-(aminomethyl)-2-methylphthalazin-1(2H)-one, BAS 00370470
| Molecular Formula | C10H11N3O |
|---|---|
| Molecular Weight | 189.09 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 58.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.09021 |
| Heavy Atoms | 14 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 49837-96-9 |
|---|---|
| SMILES | CN1C(=O)C2=CC=CC=C2C(=N1)CN |
| InChIKey | XXIJSLHCIXQDON-UHFFFAOYSA-N |
Product Overview
4-(Aminomethyl)-2-methyl-1,2-dihydrophthalazin-1-one (CAS 49837-96-9), with molecular formula C10H11N3O and molecular weight 189.09 g/mol. IUPAC: 4-(aminomethyl)-2-methylphthalazin-1-one.
Chemical Property Profile of 4-(Aminomethyl)-2-methyl-1,2-dihydrophthalazin-1-one
Property Insights of 4-(Aminomethyl)-2-methyl-1,2-dihydrophthalazin-1-one
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Aminomethyl)-2-methyl-1,2-dihydrophthalazin-1-one. With a topological polar surface area (TPSA) of 58.7 Ų, 4-(Aminomethyl)-2-methyl-1,2-dihydrophthalazin-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Aminomethyl)-2-methyl-1,2-dihydrophthalazin-1-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 4-(Aminomethyl)-2-methyl-1,2-dihydrophthalazin-1-one?
The CAS number of 4-(Aminomethyl)-2-methyl-1,2-dihydrophthalazin-1-one is 49837-96-9.
What is the molecular formula of 4-(Aminomethyl)-2-methyl-1,2-dihydrophthalazin-1-one?
The molecular formula of 4-(Aminomethyl)-2-methyl-1,2-dihydrophthalazin-1-one is C10H11N3O.
What is the molecular weight of 4-(Aminomethyl)-2-methyl-1,2-dihydrophthalazin-1-one?
The molecular weight of 4-(Aminomethyl)-2-methyl-1,2-dihydrophthalazin-1-one is 189.09 g/mol.
Where can I buy 4-(Aminomethyl)-2-methyl-1,2-dihydrophthalazin-1-one?
You can request a quote for 4-(Aminomethyl)-2-methyl-1,2-dihydrophthalazin-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Aminomethyl)-2-methyl-1,2-dihydrophthalazin-1-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(Aminomethyl)-2-methyl-1,2-dihydrophthalazin-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.